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At least 1,423 records · Page 79

Large dynamic range beam diagnostics and beam dynamics studies for high current electron LINACs

As described in the previous reports we have been working on an apodized optical system for transverse beam profile measurements by means of imaging. The key issues of LDR imaging is properly managing diffraction effects within the optical system, which is proposed to accomplish by means of amplitude apodization. Shortly before the time of the last progress report we have finished manufacturing of several apodizing elements. We have completed mechanical design of our first apodized imaging system and have built its prototype on an optical bench. Since testing diagnostic equipment with beam is costly and is not always possible due to limited beam availability, it has been our intention to make as much preliminary testing and characterization on a test bench in the laboratory.

43 PARTICLE ACCELERATORS↗

Dislocation dynamics during the growth of silicon ribbon

The thermal viscoplastic stresses and the dislocation densities in silicon ribbon are computed for an axially changing thermal profile by using an iterative finite difference method. A material constitutive equation (Haasen-Sumino model) which involves an internal variable (mobile dislocation density) is used. The results are interpreted as showing that there is a maximum width of silicon ribbon that can be grown when viscoplasticity and dislocations are considered. This maximum width limitation does not exist if the material behavior is elastic.

Dillon, O. W., Jr.↗

Radial Profiles of the Binary Fraction in Elliptical Galaxies

The radial profile of the binary fraction may vary with environment and is of significant importance for studying the formation mechanisms of binary stars and their dynamical evolution within globular clusters and galaxies. However, existing studies remain limited to the Milky Way and its neighboring galaxies. Leveraging the method proposed by Zhang et al. for estimating the variation in the binary fraction from integrated spectral features, we analyze a sample of 513 elliptical galaxies drawn from the Mapping Nearby Galaxies at Apache Point Observatory survey to measure their radial binary fraction profiles. Our results show that after accounting for the effect induced by radial variations in the stellar population (SP), the median SP-subtracted binary fraction, $r^{\textrm{med}}_{\textrm{b,sub}}$, becomes approximately flat. For nearly all elliptical galaxies in our sample, the variation in the binary fraction relative to the galaxy center at 1R e is less than 5%. No clear correlation is found between the ​​​​​gradient of the binary fraction and the gradients of the SP properties. Moreover, we also compare differences between ultraviolet (UV) upturn and non-UV upturn galaxies. The overall binary fraction profiles and the SP properties of the non-UV upturn galaxies in our sample are comparable to those of the UV upturn galaxies. This similarity may arise from the presence of residual star formation in the non-UV upturn systems.

Li, Xiejin [Chinese Academy of Sciences; Universit↗

Effects of plasma microfields on radiative transitions from atomic levels above the ionization threshold

The effects of plasma electric microfields on line-like optical features arising from atomic levels above the ionization threshold are investigated within the framework of the quasi-static and single-frequency dynamic-field theories of spectral-line broadening. The 2p(23)P to 1s2p(3)P and 2s2p(3)P to 1s2s(3)S transitions in helium and helium-like ions are treated as examples. The mixing of the doubly excited levels in the perturbing microfields produces Stark broadening of the emission lines and induces autoionization of the 2p(23)P level, which, unlike the 2s2p(3)P level, is metastable against autoionization in the field-free environment. Determination of the complete Stark-broadening profiles in thermal plasmas is complicated by the need to include the effects of both the (quasi-static) ion and the (dynamic) electron fields. Under nonequilibrium conditions, where electric fields from either electron or ion plasma waves can far exceed nearby particle fields, the calculation and interpretation of the line shapes may be simplified and could provide a diagnostic probe of the wave-field properties.

Davis, J.↗

Vertical motions of the tropical convective cloud spectrum over Darwin, Australia

Three months of profiler observations from Darwin, Australia are separated into seven cloud types (shallow, mid‐level, and deep convective; weak and robust stratiform rain; and transitional and ice‐only anvil) to provide vertical velocity statistics on the full spectrum of tropical convective clouds over the course of a monsoon season. Consistent with past studies, convective updraughts increase in height and magnitude as the convective cloud height increases. Shallow/mid‐level/deep convection has a mean maximum value of 0.3 m s −1 at 3 km/0.6 m s −1 at 5 km/2.5 m s −1 at 8 km. Deep convective extremes approach 18 m s −1 above 8 km while downdraughts in all convective cloud types are maximum below 4 km. Stratiform vertical velocities are weaker and less varied than in active convection, with maximum mean values <0.25 m s −1 . However, stratiform rain regions associated with larger near‐surface reflectivities (and thus rain rates) have stronger mesoscale up‐ and downdraughts than weaker stratiform rain regions. Anvil cloud with little or no rain near the surface also exhibits mesoscale up‐ and downdraughts, but the vertical velocity profile is shifted up in height by at least 2 km. In addition, anvil updraughts were only 20–50% of the magnitudes in the stratiform rain region. Overall, the vertical motion statistics were similar across the pre‐, active and suppressed monsoon periods. The vertical velocity distributions for each cloud type were also generally consistent with the reflectivity distributions (i.e. the strongest updraughts were often linked to the largest reflectivities), allowing for some linkages between the dynamical and microphysical cloud properties. For example, strong updraughts above the 0 °C level in deep convection are associated with strongly sloping reflectivity profiles supporting the importance of cold rain growth processes, and stronger vertical motions are associated with stratiform rain that has a robust bright band.

Schumacher, Courtney↗

On th meridional surface profile of the Gulf Stream at 55 deg W

Nine-month records from nine inverted echo sounders (IESs) are analyzed to describe the mean baroclinic Gulf Stream at 55 deg W. IES acoustic travel times are converted to thermocline depth which is optimally interpolated. Kinematic and dynamic parameters (Gulf Stream meridional position, velocity, and vorticity) are calculated. Primary Gulf Stream variabiltiy is attributed to meandering and and changes in direction. A mean, stream-coordinate (relative to Gulf Stream instantaneous position and direction) meridional profile is derived and compared with results presented by other investigators. The mean velocity is estimated at 0.84 m/s directed 14 deg to the right eastward, and the thermocline (12 c) drops 657 m (north to south), corresponding to a baroclinic rise of the surface of 0.87 m. The effect of Gulf Stream curvature on temporal mean profiles is found to be unimportant and of minimal importance overall. The derived, downstream current profile is well represented by a Gaussian function and is about 190 km wide where it crosses zero. Surface baroclinic transport is estimated to be 8.5 x 10(exp 4) sq m/s, and maximum shear (flanking the maximum) is 1.2 x 10(exp -5). Results compare well with other in situ observational results from the same time period. On the other hand, analyses (by others) of concurrent satellite altimetry (Geosat) suggest a considerable narrower, more intense mean Gulf Stream.

Hallock, Zachariah R.↗

Investigation of countercurrent flow profile and liquid holdup in random packed column with local CFD data

Liquid holdup and mass transfer area are critical parameters used in packed column design and CO 2 capture efficiency prediction. Compared to experimental methods, 3D computational fluid dynamics (CFD) can provide high-resolution data for studying countercurrent flow hydrodynamics in a packed column. In this paper, a framework was established for modeling the liquid–gas countercurrent flow in a random packed column with pall rings. Besides the column-averaged information, the radial pall ring distribution, velocity, and liquid holdup profiles are obtained in the simulations. The radial two-phase velocity and liquid holdup profiles show significant fluctuations caused by the non-uniform pall ring distribution. The entrance effect and wall influence are also observed in the packed column. By using local countercurrent flow information, the packing specific area $a_p$ and liquid velocity $u_L$ range are significantly expanded for liquid holdup hL prediction. This enables us to develop the liquid holdup correlation with one packing size and six CFD runs only. The proposed power law of the liquid holdup correlation $h_L~u_L^{0.44}$ indicates the random packed column falls in a viscous to turbulent transition regime with a Reynolds Number range of [6.7–40.2]. The derived liquid holdup correlation is in good agreement with existing correlations that are developed using the column-averaged experimental data.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Non-reactive facet specific adsorption as a route to remediation of chlorinated organic contaminants

The present work quantifies metal-contaminant interactions between palladium substrates and three salient chlorinated organic contaminants, namely trichloroethylene 1,3,5-trichlorobenzene (TCB), and 3,3′,4,4′-tetrachlorobiphenyl (PCB77). Given that Pd is one of the conventional catalytically active materials known for contaminant removal, maximizing catalytic efficiency through optimal adsorption dynamics reduces the cost of remediation of contaminants that are persistent water pollutants chronically affecting public health. Adsorption efficiency analyses from all-atom molecular dynamics (MD) simulations advance the understanding of reaction mechanisms available from density functional theory (DFT) calculations to an extractable feature scale that can fit the parametric design of supported metal catalytic systems and feed into high throughput catalyst selection. Data on residence time, site-specific adsorption, binding energies, packing geometries, orientation profiles, and the effect of adsorbate size show the anomalous behaviour of organic contaminant adsorption on the undercoordinated {110} surface as compared to the {111} and {100} surfaces. The intermolecular interaction within contaminants from molecular dynamics simulation exhibits refreshing results than ordinary single molecule density functional theory calculation. Since complete adsorption and dechlorination is an essential step for chlorinated organic contaminant remediation pathways, the presented profiles provide essential information for designing efficient remediation systems through facet-controlled palladium nanoparticles.

Guo, Hao↗

Effects of the resistivity profile on the formation of a reversed configuration and single helicity states in compressible simulations of the reversed-field pinch

Compressible magnetohydrodynamics simulations of the reversed-field pinch (RFP) are presented. Previous simulations of the RFP, including density and pressure evolution, showed that a stationary state with a reversed toroidal magnetic field could not be obtained, contrary to the results produced with numerical codes neglecting density and pressure dynamics. The simulations described in the present paper show that including density and pressure evolution, a stationary RFP configuration can be obtained if the resistivity has a radial profile steeply increasing close to the wall. Such resistivity profile is more realistic than a uniform resistivity, since the temperature at the wall is lower than in the plasma core.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Layered Model for Radiation-Induced Chemical Evolution of Icy Surface Composition and Dynamics on Kuiper Belt and Oort Cloud Bodies

The diversity of albedos and surface colors on observed Kuiper Belt and Inner Oort Cloud objects remains to be explained in terms of competition between primordial intrinsic versus exogenic drivers of surface and near-surface evolution. Earlier models have attempted without success to attribute this diversity to the relations between surface radiolysis from cosmic ray irradiation and gardening by meteoritic impacts. A more flexible approach considers the different depth-dependent radiation profiles produced by low-energy plasma, suprathermal, and maximally penetrating charged particles of the heliospheric and local interstellar radiation environment. Generally red objects of the dynamically cold (low inclination, circular orbit) Classical Kuiper Belt might be accounted for from erosive effects of plasma ions and reddening effects of high energy cosmic ray ions, while suprathermal keV-MeV ions could alternatively produce more color neutral surfaces. The deepest layer of more pristine ice can be brought to the surface from meter to kilometer depths by larger impact events and potentially by cryovolcanic activity. The bright surfaces of some larger objects, e.g. Eris, suggest ongoing resurfacing activity. Cycles of atmospheric formation and surface freezeout can further account for temporal variation as observed on Pluto. The diversity of causative processes must therefore be understood to account for observationally apparent diversities of the object surfaces.

Cooper, John F.↗

Time-dependent experimental identification of inter-ELM microtearing modes in the tokamak edge on DIII-D

In a series of discharges on the DIII-D tokamak, fast vertical plasma jogs are used to induce current perturbations in the steep gradient region of the H-mode edge. These current perturbations directly influence the edge q profile, decoupling the resonant location and instability drive of pedestal-localized microtearing modes (MTMs.) By exploiting this effect, we develop and apply a new experimental technique to track the dynamical frequency evolution of MTMs in the pedestal region, providing a compelling validation of the MTM model. The frequency of potential MTMs is calculated as the Doppler-shifted electron diamagnetic frequency at rational q=m/n surfaces, showing remarkable agreement with chirped frequency behavior of n=3, 4 and 5 modes detected with fast magnetics. Data is collected throughout multiple ELM cycles in order to build robust statistics describing the time-dependent frequency evolution of MTMs, which can be explained by examining the recovery of pedestal gradients after an ELM event. MTMs have a dominant transport contribution in the electron thermal channel, so the presented results indicate that reduced models of pedestal transport must be electromagnetic in nature and constructed with accurate calculations of MTM stability; inclusion of this physics is essential for accurate predictions of the electron temperature pedestal profile. Supporting measurements of mode saturation, propagation direction and transport fingerprints are made to support the dynamic frequency determination, unambiguously and experimentally identifying MTMs in the pedestal region of DIII-D.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Profile observations of the Arctic atmospheric boundary layer with the BELUGA tethered balloon during MOSAiC

During the Multidisciplinary drifting Observatory for the Study of Arctic Climate (MOSAiC) expedition, the Balloon-bornE moduLar Utility for profilinG the lower Atmosphere (BELUGA) was deployed from an ice floe drifting in the Fram Strait from 29 June to 27 July 2020. The BELUGA observations aimed to characterize the cloudy Arctic atmospheric boundary layer above the sea ice using a modular setup of five instrument packages. The in situ measurements included atmospheric thermodynamic and dynamic state parameters (air temperature, humidity, pressure, and three-dimensional wind), broadband solar and terrestrial irradiance, aerosol particle microphysical properties, and cloud particle images. In total, 66 profile observations were collected during 33 balloon flights from the surface to maximum altitudes of 0.3 to 1.5 km. The profiles feature a high vertical resolution of 0.01 m to 1 m, including measurements below, inside, and above frequently occurring low-level clouds. This publication describes the balloon operations, instruments, and the obtained data set. We invite the scientific community for joint analysis and model application of the freely available data on PANGAEA.

54 ENVIRONMENTAL SCIENCES↗

Dynamical system analysis of Einstein–Skyrme model in a Kantowski–Sachs spacetime

The present work deals with anisotropic (but zero heat flux) Skyrme fluid with a constant radial profile in locally rotational Kantowski–Sachs spacetime in the background of Einstein gravity. By suitably change of variables the field equations are transformed to an autonomous system. To examine the stability of the system critical points are determined. For hyperbolic critical points the analysis of the system is done using Hartman–Grobman theorem, while center manifold theory is used to analyze non-hyperbolic critical points. Also stability at infinity is analyzed to visualize the global evolution of the Universe. As a result the 3D-phase space is identified with the Poincaré 3-sphere embedded in R{sup 4}. It is found that the parameters in the autonomous system play a crucial role for phase transition of the Universe. Finally possible bifurcation scenarios are discussed to identify the point of phase transition.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Relationships between radiation, clouds, and convection during DYNAMO

In this paper, the relationships between radiation, clouds, and convection on an intraseasonal time scale are examined with data taken during the Dynamics of the Madden-Julian Oscillation (MJO) field campaign. Specifically, column-net, as well as vertical profiles of radiative heating rates, computed over Gan Island in the central Indian Ocean (IO) are used along with an objective analysis of large-scale fields to examine three MJO events that occurred during the 3 month period (October to December 2011) over this region. Longwave (LW) and shortwave radiative heating rates exhibit tilted structures, reflecting radiative effects associated with the prevalence of shallow cumulus during the dry, suppressed MJO phase followed by increasing deep convection leading into the active phase. As the convection builds going into the MJO active phase, there are increasingly top-heavy anomalous radiative heating rates while the column-net radiative cooling rate Q r progressively decreases. Temporal fluctuations in the cloud radiative forcing, being quite sensitive to changes in high cloudiness, are dominated by LW effects with an intraseasonal variation of ~0.4–0.6 K/d. While both the water vapor and cloud fields are inextricably linked, it appears that the tilted radiative structures are more related to water vapor effects. The intraseasonal variation of column-net radiative heating Q r enhances the convective signal in the mean by ~20% with a minimum in this enhancement ~10 days prior to peak MJO rainfall and maximum ~7 days after. Finally, this suggests that as MJO convective envelope weakens over the central IO, cloud-radiative feedbacks help maintain the mature MJO as it moves eastward.

54 ENVIRONMENTAL SCIENCES↗

Analysis of strain in ion implanted 4H-SiC by fringes observed in synchrotron X-ray topography

A novel high energy implantation system has been successfully developed to fabricate 4H-SiC superjunction devices for medium and high voltage via implantation of dopant atoms with multi-energies ranging from 13 to 66 MeV. The significantly higher levels of energy used compared to conventional implantation processes, necessitates detailed characterization of the lattice damage caused by implantation. To achieve this by employing the novel high energy system, 4H-SiC wafer with 12 μm epilayers were blanket implanted by 13.8–65.7 MeV Al atoms. The lattice damages induced by the implantation were primarily characterized by Synchrotron X-ray Plane Wave Topography (SXPWT) and Reciprocal Space Mapping (RSM). Topographs reveal fringe contrast akin to multiple asymmetric diffraction peaks with an angular separation of only 2″ (arcseconds) observed on rocking curves, indicating inhomogeneous strain distribution across the implanted layer. The strain profile of the implanted layer was extracted from the fringe contrast by applying Rocking-curve Analysis by Dynamical Simulation (RADS). In conclusion, the maximum strain value is similar to that measured on the RSM.

A1. Characterization↗

Dynamic Modeling for the Separation of Rare Earth Elements Using Solvent Extraction: Predicting Separation Performance Using Laboratory Equilibrium Data

Industrial rare earth element (REE) separation facilities utilize acidic cation exchange ligands such as 2-ethylhexylphosphonic acid mono-2-ethylhexyl ester (PC88A) for solvent extraction processes. REE separations are costly and difficult due to their chemical similarities and subsequent low separation factors. Several empirical correlations are available in the literature to predict steady state extraction equilibria for various solvent systems. However, complete solvent extraction flowsheet design for REE separations requires complex scrubbing and stripping circuits to separate and produce individual pure species. Furthermore, the sensitive process chemistry is susceptible to process upsets and may manifest as irreversible transients that complicate startup and continuous operation of a solvent extraction plant. Thus, dynamic modeling of REE separations will aid in process design, optimization, and management of process fluctuations. A time-dependent MATLAB/SIMULINK modeling framework has been developed for REE solvent extraction processes using laboratory equilibrium data. The model was used to develop a flowsheet that produced high purity neodymium from a 25 wt% praseodymium and 75 wt% neodymium feed. Laboratory mixer-settlers were used to verify and validate model performance. Results indicated that the model reasonably predicts the dynamic behavior of a counter-current REE separation process, and accurately predicts the steady state REE concentration profiles across the cascade. The modeling framework can be applied to any REE separation or solvent system provided adequate laboratory equilibrium data are available.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Rapidly Assessing the Quality of Targeted Proteomics Experiments through Monitoring Stable-Isotope Labeled Standards

Selected reaction monitoring (SRM), also known as multiple reaction monitoring (MRM), is a data acquisition technique used in targeted analysis of molecules, including targeted proteomic studies. It exploits the unique capability of triple-quadrupole (QQQ) mass spectrometers to monitor the predefined precursor and fragment ion pairs of specific molecules of interest throughout a liquid chromatography (LC) elution profile. Compared to shotgun proteomics, targeted proteomics using SRM has high selectivity, high sensitivity, and a wide linear dynamic range,(1-3) which makes it especially useful in the accurate and reproducible quantification of low-abundance proteins in highly complex biological samples. SRM has been widely used in the fields of biomarker discovery,(4-7) analysis of protein post-translational modifications(8) and characterization of biological protein networks.(4,9) In the recent years, multiple technical advances have greatly improved the throughput of SRM analyses, allowing for the quantification of hundreds of peptides in a single analysis.(6,7,10) For example, a single 800-plex SRM assay (e.g., 400 unlabeled and heavy-labeled peptide pairs and 2400 transitions with retention time scheduling) using ultrahigh-performance liquid chromatography (UHPLC) has been developed to quantify proteins in plasma.(11) Advanced labeling techniques utilizing in vitro proteome-assisted MRM for protein absolute quantification (iMPAQT) demonstrated the capability of SRM in genome-wide protein quantification of over 18?000 human proteins.(12) Moreover, the scan speed of QQQ instrumentation has been greatly improved in recent releases of commercial instrumentation. The newly developed TSQ Altis (released in 2017) can scan more than 600 transitions per second, which is 6 times more than a traditional QQQ scan speed of 100 transitions per second. The breadth of measurement enabled by these technological improvements to QQQ mass spectrometry has increased the feasibility and popularity of large scale targeted proteomics studies,(13) a major application of which will be in clinical studies in which up to hundreds of protein candidates need to be quantified in hundreds of clinical specimens.(14) Quantitative accuracy is a primary motivating factor for utilizing a targeted proteomics protocol. The precise and reproducible absolute quantification produced by SRM assays is essential to many clinical and laboratory experiments.(15,16) Because the abundance of an endogenous peptide is calculated from the measurement of the spiked-in reference standard, it is essential to assess the data quality of these references.(17) In early applications of targeted proteomics, when instrument speed greatly limited the number of transitions that could be monitored, much of this quality assessment was done manually. However, recent improvements in instrument performance and experimental design have enabled a dramatic increase in the number of target peptides and associated SRM transitions, which makes manual quality assessment an untenable and laborious task. A variety of computational tools assist in SRM experiment design and data analysis. The first task in creating an SRM experiment is the choice of proteins and representative peptides to monitor. Achieving a reliable protein abundance requires appropriately choosing peptides that have a strong signal and are free from interferences in the biological matrix. Numerous computational tools exist to facilitate assay design by identifying peptides and refining SRM transitions.(18-21) To help share these assays and eliminate time spent designing the same transitions at multiple institutions, community portals have begun to host well-designed and vetted assays.(22-24) Analyzing the experimental data requires significant computational effort to align files across replicates and experimental conditions, pick peaks and produce quantitative values, normalize data and perform statistical tests, etc.(25-27)

Gibbons, Bryson C.↗

Molecular Mechanism for Isoform-Selective Inhibition of Acyl Protein Thioesterases 1 and 2 (APT1 and APT2)

Post-translational S-palmitoylation directs the trafficking and membrane localization of hundreds of cellular proteins, often involving a coordinated palmitoylation cycle that requires both protein acyl transferases (PATs) and acyl protein thioesterases (APTs) to actively redistribute S-palmitoylated proteins toward different cellular membrane compartments. This process is necessary for the trafficking and oncogenic signaling of S-palmitoylated Ras isoforms, and potentially many peripheral membrane proteins. The depalmitoylating enzymes APT1 and APT2 are separately conserved in all vertebrates, suggesting unique functional roles for each enzyme. The recent discovery of the APT isoform-selective inhibitors ML348 and ML349 has opened new possibilities to probe the function of each enzyme, yet it remains unclear how each inhibitor achieves orthogonal inhibition. Herein, we report the high-resolution structure of human APT2 in complex with ML349 (1.64 Å), as well as the complementary structure of human APT1 bound to ML348 (1.55 Å). Although the overall peptide backbone structures are nearly identical, each inhibitor adopts a distinct conformation within each active site. In APT1, the trifluoromethyl group of ML348 is positioned above the catalytic triad, but in APT2, the sulfonyl group of ML349 forms hydrogen bonds with active site resident waters to indirectly engage the catalytic triad and oxyanion hole. Reciprocal mutagenesis and activity profiling revealed several differing residues surrounding the active site that serve as critical gatekeepers for isoform accessibility and dynamics. Structural and biochemical analysis suggests the inhibitors occupy a putative acyl-binding region, establishing the mechanism for isoform-specific inhibition, hydrolysis of acyl substrates, and structural orthogonality important for future probe development.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗