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Results for “Shape Optimization”

Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 739 records · Page 41
All sourcesNASA NTRSDOE OSTI
DOE OSTI2015

SU-E-T-65: A Prospective Trial of Open Face Masks for Head and Neck Radiotherapy

Purpose: Open face head and neck masks allow for active patient monitoring during treatment and may reduced claustrophobia and anxiety compared to closed masks. The ability of open masks to limit intrafraction motion and to preserve the patient shape/position from simulation over protracted treatments should be considered. Methods: Thirty-two head and neck patients were prospectively randomized to treatment in a closed mask or a novel open face mask. All patients received daily volumetric imaging. The daily images were automatically rigidly registered to the planning CT’s offline using a commercial image processing tool. The shifts needed to optimize the registration, the mutual information coefficient (MI), and the Pearson correlation (PC) coefficients were recorded to evaluate shape preservation. The open group was set-up and monitored with surface imaging at treatment. The real time surface imaging information was recorded to evaluate intrafraction motion. Results: Sixteen patients were included in each group. Evaluations were made over a total of 984 fractions. The mean MI and PC showed significantly higher shape preservation for the open group than for the closed group (p = 0). The mean rotations for the open group were smaller or < 0.15° larger versus the closed group. The mean intrafraction motion for the open group was 0.93 +/−0.99 mm (2 SD). The maximum single fraction displacement was 3.2 mm. Fourteen of 16 patients showed no significant correlation of motion with fraction number (p > 0.05). Conclusion: The open masks preserved shape as well as the closed masks, and they limited motion to < 2 mm for 95% of the treated fractions. These results are consistent over treatment courses of up to 35 fractions. The open mask is suitable for treatment with or without active monitoring. This work was partially supported by Qfix.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2024

A chemical kinetics theory for interpreting the non-monotonic temperature dependence of enzymatic reactions

Abstract. One notable observation of enzymatic chemical reactions is that, for a given abundance of enzymes and substrates, temperature increases cause reaction rates to first increase consistent with the Arrhenius relationship, then plateau, and finally fall off quickly to zero at high temperatures. While many mathematical functions have been used to describe this pattern, we here propose a chemical kinetics theory which successfully replicates this observation and provides insights into the processes responsible for these dynamics. The chemical kinetics theory combines the law of mass action, von Smoluchowski's diffusion-limited chemical reaction theory, and Eyring's transition state theory. This new theory reveals that the thermally reversible enzyme denaturation ensured by the ceaseless thermal motion of molecules and ions in an enzyme solution explains the plateau and subsequent decrease in chemical reaction rates with increasing temperature. The temperature-dependent affinity parameter (K) that relates enzymes and substrates through their binding also affects the shape of the emergent temperature response. We demonstrate that with an increase in substrate availability, K shifts the optimal temperature, where reaction rates plateau, towards higher values. Further, we show that the chemical kinetics theory accurately represents 12 sets of published enzyme assay data and includes the popular mechanistic model by Ratkowsky et al. (2005) as a special case. Given its good performance and solid theoretical underpinning, we believe this new theory will facilitate the construction of more mechanistic-based environmental biogeochemical models.

Tang, Jinyun↗
DOE OSTI2015

Light collection optimization for composite photoanode in dye-sensitized solar cells: Towards higher efficiency

Composite photoanode comprising nanoparticles and one-dimensional (1D) nanostructure is a promising alternative to conventional photoanode for dye-sensitized solar cells (DSCs). Besides fast electron transport channels, the 1D nanostructure also plays as light scattering centers. Here, we theoretically investigate the light scattering properties of capsule-shaped 1D nanostructure and their influence on the light collection of DSCs. It is found that the far-field light scattering of a single capsule depends on its volume, shape, and orientation: capsules with bigger equivalent spherical diameter, smaller aspect ratio, and horizontal orientation demonstrate stronger light scattering especially at large scattering angle. Using Monte Carlo approach, we simulated and optimized the light harvesting efficiency of the cell. Two multilayer composite photoanodes containing orderly or randomly oriented capsules are proposed. DSCs composed of these two photoanodes are promising for higher efficiencies because of their efficient light collection and superior electron collection. These results will provide practical guidance to the design and optimization of the photoanodes for DSCs.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2016

Technical Note: A novel leaf sequencing optimization algorithm which considers previous underdose and overdose events for MLC tracking radiotherapy

Purpose: Multileaf collimator (MLC) tracking radiotherapy is complex as the beam pattern needs to be modified due to the planned intensity modulation as well as the real-time target motion. The target motion cannot be planned; therefore, the modified beam pattern differs from the original plan and the MLC sequence needs to be recomputed online. Current MLC tracking algorithms use a greedy heuristic in that they optimize for a given time, but ignore past errors. To overcome this problem, the authors have developed and improved an algorithm that minimizes large underdose and overdose regions. Additionally, previous underdose and overdose events are taken into account to avoid regions with high quantity of dose events. Methods: The authors improved the existing MLC motion control algorithm by introducing a cumulative underdose/overdose map. This map represents the actual projection of the planned tumor shape and logs occurring dose events at each specific regions. These events have an impact on the dose cost calculation and reduce recurrence of dose events at each region. The authors studied the improvement of the new temporal optimization algorithm in terms of the L1-norm minimization of the sum of overdose and underdose compared to not accounting for previous dose events. For evaluation, the authors simulated the delivery of 5 conformal and 14 intensity-modulated radiotherapy (IMRT)-plans with 7 3D patient measured tumor motion traces. Results: Simulations with conformal shapes showed an improvement of L1-norm up to 8.5% after 100 MLC modification steps. Experiments showed comparable improvements with the same type of treatment plans. Conclusions: A novel leaf sequencing optimization algorithm which considers previous dose events for MLC tracking radiotherapy has been developed and investigated. Reductions in underdose/overdose are observed for conformal and IMRT delivery.

61 RADIATION PROTECTION AND DOSIMETRY↗
DOE OSTI2026

Engineering Antifreeze Proteins to Optimally Resist Engulfment by Ice

Antifreeze proteins (AFPs) facilitate the survival of organisms in cold climates by inhibiting the growth and/or recrystallization of ice. To function, AFPs must first bind to ice crystals; bound AFPs must then resist engulfment by using their nonbinding side (NBS) to pin the ice–water interface. Here, we seek to understand how the molecular characteristics of an NBS, such as its ice-phobicity or shape, influence its ability to resist engulfment. By characterizing the free energy barriers that impede the engulfment of model AFPs, we find that the critical supercooling ΔT*, above which an AFP is engulfed, is dictated by an optimal pinning site on the NBS. We further find that the optimal pinning site is determined by an interplay between the contact line perimeter P and a pinning efficiency η, with ΔT* ∝ ηP at the optimal pinning site. For a hemispherical AFP, which displays progressively inward tapering, we find that η increases during engulfment, whereas P decreases; conversely, an NBS with outward tapering can achieve high P, but it suffers from low η. Because the product of η and P determines ΔT*, the inverse correlation between them limits ΔT. To circumvent such limiting behavior, we propose an NBS shape with an outward bulge; by initially tapering outward, a bulged NBS permits higher P, and by subsequently tapering inward, it promotes high η as well. Importantly, we find that ΔT* is enhanced by more than a factor of 2 with an outward bulge of only 1 nm. We also find that the more ice-phobic an NBS is, the more efficiently it pins the ice–water interface, resulting in a higher ΔT. Furthermore, our findings shed light on how the NBS molecular characteristics influence ΔT* and suggest strategies for engineering the NBS to optimally resist engulfment by ice.

Antifreeze↗
DOE OSTI2017

S-Shaped Suppression of the Superconducting Transition Temperature in Cu-Intercalated NbSe 2

2H-NbSe 2 is the prototype and most frequently studied of the well-known transition metal dichalcogenide (TMDC) superconductors. As 2H-NbSe 2 is widely acknowledged as a conventional superconductor, its transition temperature to the superconducting state (T c ) is 7.3 K, a T c that is substantially higher than those seen for the majority of TMDCs, where Tc values between 2 and 4 K are the norm. We report the intercalation of Cu into 2H-NbSe 2 to make Cu x NbSe 2 . As is typically found when chemically altering an optimal superconductor, T c decreases with an increase in x, but the way that Tc is suppressed in this case is unusual: an S-shaped character is observed, with an inflection point near x = 0.03 and, at higher x values, a leveling off of the T c near 3 K, down to the usual value for a layered TMDC. Electronic characterization reveals corresponding S-like behavior for many of the parameters of the materials that influence T c . In order to illustrate its character, the superconducting phase diagram for Cu x NbSe 2 is contrasted with those of FexNbSe 2 and NbSe 2–x S x .

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2023

An adaptive moments-based interface reconstruction using intersection of the cell with one half-plane, two half-planes and a circle

We present a new adaptive moment-of-fluid (A-MOF) interface reconstruction method. It uses the zeroth, first, and second moments of the fragment of material inside a cell of the mesh to construct a shape that approximates the respective material fragment. The new method requires information about the material moments only for the cell under consideration. The adaptive method chooses between shapes obtained by the intersection of the cell with one half-plane, two half-planes, or a circle. The A-MOF method allows to exactly reproduce several convex shapes: corners, filaments, and their concave cell-complements; as well as pieces of the circles and its cell-compliments. Interface reconstruction is formulated as a local (for each cell), non-linear, equality constrained optimization problem, which does not require additional communication and allows for an efficient parallel implementation. In conclusion, we present an extensive set of test problems, both for interface reconstruction on a single cell, and for reconstruction of a variety of shapes on the entire mesh.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2019

LaserOrigami (LO) of three-dimensional (3D) components: Experimental analysis and numerical modeling-part II

The present work explores how the choice of the scanning patterns can affect the final shapes of 3D components manufactured by laser-origami with a High-Power Diode Laser (HPDL). The experimental approach allowed the achievement of high bending angles, also avoiding any distortion on the surface of AISI 304 stainless steel workpiece. Optimization of the operational parameters led to the best prototype of the 3D components, with the closest respect of the strictest dimensional and geometrical tolerances. In addition, a thermo-mechanical model to predict the final shape of the 3D components was developed. The numerical model, implemented by Finite Element Method (FEM), was discovered to be a reliable tool in predicting the final shape of the prototypes, matching with a great deal of accuracy the experimental results. Specifically, the model allowed the estimation of the temperature distribution and nodal displacements of the components varying both the setting of the laser parameters and the choice of the scanning patterns.

47 OTHER INSTRUMENTATION↗
DOE OSTI2018

Progress in Critical Current Density (J{sub c}) in Sintered MgB{sub 2} Bulks

The present paper focuses on methods of further improving the flux pinning and critical current density of disk-shaped MgB{sub 2} bulk superconductors by adding excess Mg metal in combination with an optimum silver content and optimized processing conditions. Bulk MgB{sub 2} samples were produced by in situ solid-state reaction in Ar gas ambient using high purity commercial powders of Mg metal and 1.5 wt% carbon-coated amorphous B powders mixed in a fixed ratio of Mg/B = 1.1:2. Further, 4 wt% silver was added to improve flux pinning as well as mechanical performance of the bulk MgB{sub 2} material. The magnetization measurements confirmed a sharp superconducting transition with T{sub c,onset} at around 37 K, which is only by 1 K lower than in bulk MgB{sub 2} material produced without carbon-coated amorphous boron. The critical current density (J{sub c}) values significantly improved in the MgB{sub 2} material with 4 wt% of silver and 1.5 wt% of carbon-coated amorphous boron, sintered at 775 {sup ∘}C for 3 h. At 20 K, this sample showed J{sub c} at around 500 and 350 kA/cm{sup 2} in the self-field and 1 T, respectively, which makes it suitable for several industrial applications.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2020

Modeling Nonperturbative Field-Driven Vibronic Dynamics: Selective State Preparation and Nonlinear Spectroscopy

The partially linearized density matrix formalism for nonadiabatic dynamics is adapted to incorporate a classical external electromagentic field into the system Hamiltonian. This advancement encompasses the possibility of describing field-driven dynamics and computing a variety of linear and nonlinear spectroscopic signals beyond the perturbative limit. Here, the capabilities of the developed approach are demonstrated on a simple two-state vibronic model coupled to a bath, for which we (a) perform an exhaustive search in the field parameter space for optimal state preparation and (b) compute time-resolved transient absorption spectroscopy to monitor the effect of different pulse shapes on measurable experimental signals. While no restrictions on the form of the field have to be assumed, we focus here on Gaussian shaped (linearly) chirped pulses.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Extension of charged-particle spectrometer capabilities for diagnosing implosions on OMEGA, Z, and the NIF

New designs and a new analysis technique have been developed for an existing compact charged-particle spectrometer on the NIF and OMEGA. The new analysis technique extends the capabilities of this diagnostic to measure arbitrarily shaped ion spectra down to 1 MeV with yields as low as 10 6 . Three different designs are provided optimized for the measurement of DD protons, T 3 He deuterons, and 3 He 3 He protons. The designs are highly customizable, and a generalized framework is provided for optimizing the design for alternative applications. Additionally, the understanding of the detector’s response and uncertainties is greatly expanded upon. A new calibration procedure is also developed to increase the precision of the measurements.

47 OTHER INSTRUMENTATION↗
DOE OSTI2015

APODIZED PUPIL LYOT CORONAGRAPHS FOR ARBITRARY APERTURES. IV. REDUCED INNER WORKING ANGLE AND INCREASED ROBUSTNESS TO LOW-ORDER ABERRATIONS

The Apodized Pupil Lyot Coronagraph (APLC) is a diffraction suppression system installed in the recently deployed instruments Palomar/P1640, Gemini/GPI, and VLT/SPHERE to allow direct imaging and spectroscopy of circumstellar environments. Using a prolate apodization, the current implementations offer raw contrasts down to 10{sup –7} at 0.2 arcsec from a star over a wide bandpass (20%), in the presence of central obstruction and struts, enabling the study of young or massive gaseous planets. Observations of older or lighter companions at smaller separations would require improvements in terms of the inner working angle (IWA) and contrast, but the methods originally used for these designs were not able to fully explore the parameter space. We propose a novel approach to improve the APLC performance. Our method relies on the linear properties of the coronagraphic electric field with the apodization at any wavelength to develop numerical solutions producing coronagraphic star images with high-contrast region in broadband light. We explore the parameter space by considering different aperture geometries, contrast levels, dark-zone sizes, bandpasses, and focal plane mask sizes. We present an application of these solutions to the case of Gemini/GPI with a design delivering a 10{sup –8} raw contrast at 0.19 arcsec and offering a significantly reduced sensitivity to low-order aberrations compared to the current implementation. Optimal solutions have also been found to reach 10{sup –10} contrast in broadband light regardless of the aperture shape, with effective IWA in the 2-3.5 λ/D range, therefore making the APLC a suitable option for the future exoplanet direct imagers on the ground or in space.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2018

Design and simulation of the snowflake divertor control for NSTX-U

This study presents the development of a physics-based multiple-input-multiple-output algorithm for real-time feedback control of snowflake divertor (SFD) configurations on the National Spherical Torus eXperiment Upgrade (NSTX-U). A model of the SFD configuration response to applied voltages on the divertor control coils is first derived and then used, in conjunction with multivariable control synthesis techniques, to design an optimal state feedback controller for the configuration. To demonstrate the capabilities of the controller, a nonlinear simulator for axisymmetric shape control was developed for NSTX-U which simultaneously evolves the currents in poloidal field coils based upon a set of feedback-computed voltage commands, calculates the induced currents in passive conducting structures, and updates the plasma equilibrium by solving the free-boundary Grad-Shafranov problem. Closed-loop simulations demonstrate that the algorithm enables controlled operations in a variety of SFD configurations and provides capabilities for accurate tracking of time-dependent target trajectories for the divertor geometry. In particular, simulation results suggest that a time-varying controller which can properly account for the evolving SFD dynamical response is not only desirable but necessary for achieving acceptable control performance. The algorithm presented in this paper has been implemented in the NSTX-U Plasma Control System in preparation for future control and divertor physics experiments.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2015

Robust primary modulation-based scatter estimation for cone-beam CT

Purpose: Scattered radiation is one of the major problems facing image quality in flat detector cone-beam computed tomography (CBCT). Previously, a new scatter estimation and correction method using primary beam modulation has been proposed. The original image processing technique used a frequency-domain-based analysis, which proved to be sensitive to the accuracy of the modulator pattern both spatially and in amplitude as well as to the frequency of the modulation pattern. In addition, it cannot account for penumbra effects that occur, for example, due to the finite focal spot size and the scatter estimate can be degraded by high-frequency components of the primary image. Methods: In this paper, the authors present a new way to estimate the scatter using primary modulation. It is less sensitive to modulator nonidealities and most importantly can handle arbitrary modulator shapes and changes in modulator attenuation. The main idea is that the scatter estimation can be expressed as an optimization problem, which yields a separation of the scatter and the primary image. The method is evaluated using simulated and experimental CBCT data. The scattering properties of the modulator itself are analyzed using a Monte Carlo simulation. Results: All reconstructions show strong improvements of image quality. To quantify the results, all images are compared to reference images (ideal simulations and collimated scans). Conclusions: The proposed modulator-based scatter reduction algorithm may open the field of flat detector-based imaging to become a quantitative modality. This may have significant impact on C-arm imaging and on image-guided radiation therapy.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2019

Design and simulation of the snowflake divertor control for NSTX-U

This paper presents the development of a physics-based multiple-input-multiple-output algorithm for real-time feedback control of snowflake divertor (SFD) configurations on the National Spherical Torus eXperiment Upgrade (NSTX-U). A model of the SFD configuration response to applied voltages on the divertor control coils is first derived and then used, in conjunction with multivariable control synthesis techniques, to design an optimal state feedback controller for the configuration. To demonstrate the capabilities of the controller, a nonlinear simulator for axisymmetric shape control was developed for NSTX-U which simultaneously evolves the currents in poloidal field coils based upon a set of feedback-computed voltage commands, calculates the induced currents in passive conducting structures, and updates the plasma equilibrium by solving the free-boundary Grad-Shafranov problem. Closed-loop simulations demonstrate that the algorithm enables controlled operations in a variety of SFD configurations and provides capabilities for accurate tracking of time-dependent target trajectories for the divertor geometry. In particular, simulation results suggest that a time-varying controller which can properly account for the evolving SFD dynamical response is not only desirable but necessary for achieving acceptable control performance. The algorithm presented in this paper has been implemented in the NSTX-U Plasma Control System in preparation for future control and divertor physics experiments.

snowflake divertor, MIMO feedback control, nonline↗
DOE OSTI2023

Modeling the Yaw Behavior of Tail Fins for Small Wind Turbines: November 22, 2021 - May 21, 2024

This report describes the aerodynamic modelling of the yaw behavior of tail fins for small wind turbines (SWTs). The analysis is based on unsteady slender body theory (USBT) and is formulated to be used with the proposed tail fin module to be added to OpenFAST. Linearized USBT, which has been applied in the past to SWT tail fins, is developed in three main ways. First, USBT is extended to high yaw angles and aspect ratios by modelling the associated nonlinear vortex dynamics and the chordwise load distribution respectively. Second, we consider the effect of time-varying wind speed. The extended theory is compared to recent unpublished measurements at the University of Perugia, Italy, for the yaw behavior of delta, elliptical, and rectangular tail fins without a rotor and nacelle. The fins were released from initial yaw angles of -40 degrees and -80 degrees ; the latter is of sufficient magnitude to show the importance of the nonlinear yaw dynamics. Further, the friction in the model tail fin bearings was measured and modelled. The constants in the aerodynamic models were taken from the literature but significant improvement in accuracy is achieved by using system identification techniques to optimize the values. This leads to the third main finding: extended USBT is accurate for all generic tail fin shapes that we considered and is, therefore, very suitable for inclusion in aeroelastic codes for SWTs. The final development is of a general nonlinear equation for yaw response that is simpler than the extended USBT and is also suitable for inclusion in OpenFAST. The two nonlinear models are used to highlight the geometric requirements for good tail fin design.

distributed wind↗
DOE OSTI2019

Computational 3D histological phenotyping of whole zebrafish by X-ray histotomography

Organismal phenotypes frequently involve multiple organ systems. Histology is a powerful way to detect cellular and tissue phenotypes, but is largely descriptive and subjective. To determine how synchrotron-based X-ray micro-tomography (micro-CT) can yield 3-dimensional whole-organism images suitable for quantitative histological phenotyping, we scanned whole zebrafish, a small vertebrate model with diverse tissues, at ~1 micron voxel resolutions. Micro-CT optimized for cellular characterization (histotomography) allows brain nuclei to be computationally segmented and assigned to brain regions, and cell shapes and volumes to be computed for motor neurons and red blood cells. Striking individual phenotypic variation was apparent from color maps of computed densities of brain nuclei. Unlike histology, the histotomography also allows the study of 3-dimensional structures of millimeter scale that cross multiple tissue planes. We expect the computational and visual insights into 3D cell and tissue architecture provided by histotomography to be useful for reference atlases, hypothesis generation, comprehensive organismal screens, and diagnostics.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2025

Tailoring spectral properties for entangled photon generation

The linear intensity scaling of entangled two-photon absorption (ETPA) offers a fundamental mechanism to enable nonlinear optical spectroscopy and microscopy under a substantially lower excitation power than is currently feasible. However, the long data acquisition time and low signal-to-noise ratio in reported ETPA-based spectroscopic and microscopic studies prevent its widespread application. To gain the full potential of this novel quantum light approach, it is essential to optimize entangled photon generation for significantly enhanced ETPA responses. Here, we report a new quantum light source by combining entangled photon generation with free-space femtosecond pump-pulse shaping. Here, through measurements of singles and coincidence counts by varying the patterns applied to a spatial light modulator to control the spectral widths of the pump pulses, we reveal strong dependence of the singles and coincidence count rates as well as their ratios on the spectral widths of pump pulses. An optimal spectral width for the highest ratios between the coincidence photon and the signal or idler photon count rates is also determined. Identification of such optimal spectral widths for entangled photon generation in the presence of postgeneration spectral selection makes this quantum light source a promising choice for ETPA-based spectroscopy and imaging.

Photon pairs & parametric down-conversion↗