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At least 1,765 records · Page 98
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Unexpected Formation of Metallofulleroids from Multicomponent Reactions, with Crystallographic and Computational Studies of the Cluster Motion

New multicomponent reactions involving an isocyanide, terminal or internal alkynes, and endohedral metallofullerene (EMF) Lu 3 N@C 80 yield metallofulleroids which are characterized by massspectrometry, HPLC, and multiple 1D and 2D NMR techniques. Single crystal studies revealed one ketenimine metallofulleroid has ordered Lu 3 N cluster which is unusual for EMF monoadducts. Computational analysis, based on crystallographic data, confirm that the endohedral cluster motion is controlled by the position of the exohedral organic appendants. Furthermore, our findings provide a new functionalization reaction for EMFs, and a potential facile approach to freeze the endohedral cluster motion at relatively high temperatures.

36 MATERIALS SCIENCE↗
DOE OSTI2015

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↗
DOE OSTI2025

Imaging Bias‐Driven Domain Wall Motion With Scanning Oscillator Piezoresponse Force Microscopy

Understanding ferroelectric domain wall dynamics at the nanoscale across a broad range of timescales requires measuring domain wall position under different applied electric fields. The success of piezoresponse force microscopy (PFM) as a tool to apply local electric fields at different positions and imaging their changing position, together with the information obtained from associated switching spectroscopies has fueled numerous studies of the dynamics of ferroelectric domains to determine the impact of intrinsic parameters such as crystalline order, defects and pinning centers, as well as boundary conditions such as environment. However, the investigation of sub-coercive reversible domain wall vibrational modes requires the development of new tools that enable visualizing domain wall motion under varying applied fields with high temporal and spatial resolution while also accounting for spurious electrostatic effects. Here, scanning oscillator piezoresponse force microscopy extends the investigation of domain wall dynamics to new regimes, providing direct visualization of domain wall position as a function of an external electric field that varies in time and location. In conclusion, this enables studying the energetics of field-driven ferroelectric domain wall motion, which is shown to obey a thermally activated flow regime in the millisecond timescale.

Piezoresponse Force Microscopy↗
DOE OSTI2019

Estimation of full-field dynamic strains from digital video measurements of output-only beam structures by video motion processing and modal superposition

Strain is an necessary quantity to characterize local structural behaviors and directly correlates with structural damage initiation and development that is within local regions. Strain measurement at high spatial resolution (density) locations is thus required to characterize local structural behaviors and detect potential local damage. Traditional contact-type strain gauges are mostly discrete point-wise sensors that can only be placed in a limited number of positions. Distributed optical fiber sensing techniques can measure strains at spatially dense measurement points, but their instrumentation is a time- and labor-intensive process associated with the issue of the fragility of fibers. Noncontact optical measurement techniques, such as a family of interferometry techniques using laser beams (e.g., laser Doppler vibrometers), can provide vibration measurement at high density spatial points without the need to install sensors on the structure. Yet, these measurement devices are active sensing methods that are relatively expensive and vulnerable to ambient motion. Photogrammetry is an alternative noncontact optical measurement method using (passive) white-light imaging of digital video cameras that are relatively low-cost, agile, and provides simultaneous measurements at high spatial density locations where every pixel becomes a measurement point. Among others, digital image correlation can achieve full-field deformation measurements and subsequently estimate the full-field strains. However, it is computationally extensive. This research develops a new efficient approach to estimate the full-field (as many measurement points as the pixel number of the video frame on the structure) dynamic strains at high-spatial (pixel)-resolution/density location points from the digital video measurement of output-only vibrating structures. The developed approach is based on phase-based video motion estimation and modal superposition of structural dynamic response. Moreover, the method is augmented by a high-fidelity finite element model, which is updated with the full-field experimental modal parameters “blindly” identified from the video measurement of the output-only structure. Laboratory experiments are conducted to validate the method on a bench-scale cantilever beam structure. Results demonstrate that the full-field dynamic strain estimated by the developed approach from the video measurement of the output-only vibrating beam match very well those directly measured by the strain gauges (at discrete measurement points). Some factors associated with the effectiveness of the method are experimentally studied and discussed.

47 OTHER INSTRUMENTATION↗
DOE OSTI2022

A Topological Approach for Motion Track Discrimination

Detecting small targets at range is difficult because there is not enough spatial information present in an image sub-region containing the target to use correlation-based methods to differentiate it from dynamic confusers present in the scene. Moreover, this lack of spatial information also disqualifies the use of most state-of-the-art deep learning image-based classifiers. Here, we use characteristics of target tracks extracted from video sequences as data from which to derive distinguishing topological features that help robustly differentiate targets of interest from confusers. In particular, we calculate persistent homology from time-delayed embeddings of dynamic statistics calculated from motion tracks extracted from a wide field-of-view video stream. In short, we use topological methods to extract features related to target motion dynamics that are useful for classification and disambiguation and show that small targets can be detected at range with high probability.

Emerson, Tegan H.↗
DOE OSTI2022

Model for Independent Particle Motion

Independent particle model in nuclear physics assumes that the nucleon in the nucleus moves in the average (mean field) potential generated by all other nucleons. This chapter gives a short overview of basic features of the independent particle motion in atomic nuclei and its theoretical realization in the framework of shell models for spherical, deformed, and rotating nuclei as well as in more sophisticated approaches such as microscopic+macroscopic model and density functional theories. Independent particle motion of nucleons leads to global and single-particle consequences. The global ones manifest themselves in the shell structure, and its consequences for the global structure of nuclear landscape, the existence of superheavy nuclei, and the superdeformation at high spin are briefly reviewed. Finally, the latter shows itself in the single-particle properties such as energies, alignments, and densities; their manifestations are illustrated on specific examples.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2018

Entropy, extremality, euclidean variations, and the equations of motion

We study the Euclidean gravitational path integral computing the Rényi entropy and analyze its behavior under small variations. We argue that, in Einstein gravity, the extremality condition can be understood from the variational principle at the level of the action, without having to solve explicitly the equations of motion. This set-up is then generalized to arbitrary theories of gravity, where we show that the respective entanglement entropy functional needs to be extremized. We also extend this result to all orders in Newton’s constant G N , providing a derivation of quantum extremality. Understanding quantum extremality for mixtures of states provides a generalization of the dual of the boundary modular Hamiltonian which is given by the bulk modular Hamiltonian plus the area operator, evaluated on the so-called modular extremal surface. This gives a bulk prescription for computing the relative entropies to all orders in G N . We also comment on how these ideas can be used to derive an integrated version of the equations of motion, linearized around arbitrary states.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Growth of organized flow coherent motions within a single-stream shear layer: 4D-PTV measurements

Abstract This study investigates the evolution of a single-stream shear layer (SSSL) originating from a wall boundary layer past a backward-facing step. Utilizing a time-resolved 3D-Particle Tracking Velocimetry (4D-PTV) technique, we track the trajectories of fluorescent particles to gain insight into the flow characteristics of the SSSL. A compact water tunnel facility ( $$\textrm{Re}_\tau =1\,240$$ Re τ = 1 240 ) is fabricated to obtain an SSSL with a perpendicular slow entrainment stream past the separation edge. A hybrid interpolation approach that combines ensemble binning and Gaussian weighting is implemented to derive minimally filtered mean and instantaneous lower- and higher-order flow field parameters. Spanwise-dominant coherent motion accompanied by finer flow scales is observed to grow due to flow entrainment through “nibbling” actions of small-scale vortices, “engulfing” by large-scale vortices, and vortex pairing events. Furthermore, the non-zero-speed stream edge grows relatively faster than the zero-speed stream edge, showing a strong asymmetry in mixing composition across a mixing layer. The SSSL reaches self-similarity at a streamwise distance of $$\approx 55\,\theta _{0}$$ ≈ 55 θ 0 , where $$\theta _0$$ θ 0 is the initial momentum thickness from the separation edge, i.e., considerably shorter than reported in previous studies. A literature comparison of growth rate parameters raises intriguing questions regarding a potential inclusive growth scaling unifying the free shear layers. A turbulent kinetic energy (TKE) budget analysis reveals a negative production region immediately downstream of the separation edge attributed to a large positive streamwise gradient of streamwise velocity. In the self-similar region, the phase-averaged flow mapping demonstrates a larger concentration of turbulence production rate around the outer edges of spanwise vortices, specifically at the intersection of braids and vortices. Furthermore, a spatial separation exists in the regions of peak production and dissipation rates within the vortex core region favoring dissipation. The braids exhibit a larger concentration of turbulence diffusion rates, indicating their function as a conduit for exchanging turbulence between neighboring coherent motions.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2018

Motion of a Rigid Body in a Special Lorentz Gas: Loss of Memory Effect

Linear motion of a rigid body in a special kind of Lorentz gas is mathematically analyzed. The rigid body moves against gas drag according to Newton’s equation. The gas model is a special Lorentz gas consisting of gas molecules and background obstacles, which was introduced in Tsuji and Aoki (J Stat Phys 146:620–645, 2012). The specular boundary condition is imposed on the resulting kinetic equation. This study complements the numerical study by Tsuji and Aoki cited above—although the setting in this paper is slightly different from theirs, qualitatively the same asymptotic behavior is proved: The velocity V(t) of the rigid body decays exponentially if the obstacles undergo thermal motion; if the obstacles are motionless, then the velocity V(t) decays algebraically with a rate t{sup − 5} independent of the spatial dimension. This demonstrates the idea that interaction of the molecules with the background obstacles destroys the memory effect due to recollision.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Energy of Motion of Internal and Surface Waves in a Two-Layer Hydrodynamic System

We study the energy of wave motion in a two-layer “layer with solid bottom–layer with free surface” hydrodynamic system. The dependences of the energies of motion of internal and surface waves on the geometric and physical parameters of the system are analyzed. The contribution of the second approximation to the total energy of the system is estimated. The reliability of the obtained results is verified. The results are graphically illustrated.

42 ENGINEERING↗
DOE OSTI2019

Polarization Amplitude-Based Method of Determining the Bearing and Roll Angles of an Object in Motion from Orthogonal Circularly Polarized Signals of a Radio Beacon

The possibility of determining the bearing and roll angles of an object in motion is investigated based on orthogonal left- and right-hand circularly polarized signals simultaneously radiated by a radio beacon from two points with the known coordinates spatially spaced in the horizontal plane. The bearing and roll angles are determined onboard the object in motion using a two-channel receiving system based on polarization amplitude-based processing of resultant vector signals received in a linear polarization basis.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Stimulated Motion Suppression (STMS): a New Approach to Break the Resolution Barrier for Ion Trap Mass Spectrometry

Ion trap is an excellent platform to perform tandem mass spectrometry (MS/MS), but has an intrinsic drawback in resolving power. Using ion resonant ejection as an example, the resolution degradation can be largely attributed to the broadening of the resonant frequency band (RFB) between ion motion and driving alternative-current (AC). To solve this problem, stimulated motion suppression (STMS) was developed. The key idea of STMS is the use of two suppression alternative-current (SAC) signals, which both have reversed initial phases to the main AC. The SACs can block the unexpected sideband ion resonances (or ejections), therefore playing a key role in sharpening the RFB. The proof-of-concept has been demonstrated through ion trajectory simulations and validated experimentally. STMS provides a new and versatile means for the improvement of the ion trap resolution, which for a long time has reached the bottleneck through conventional methods, e.g., increasing the radio-frequency (RF) voltage and decreasing the mass scan rate. At the end, it is worth noting that the idea of STMS is very general and principally can be applied in any RF device for the purposes of high-resolution mass analysis and ion isolation. .

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2020

Predicting 3D Motions from Single-Camera Optical Test Data

In a typical optical test, a stereo camera pair is required to measure the three-dimensional motion of a test article; one camera typically only measures motions in the image plane of the camera, and measurements in the out-of-plane direction are missing. Finite element expansion techniques provide a path to estimate responses from a test at unmeasured degrees of freedom. Treating the case of a single camera as a measurement with unmeasured degrees of freedom, a finite element model is used to expand to the missing third dimension of the image data, allowing a full-field, three-dimensional measurement to be obtained from a set of images from a single camera. The key to this technique relies on the mapping of finite element deformations to image deformations, creating a set of mode shape images that are used to filter the response in the image into modal responses. These modal responses are then applied to the finite element model to estimate physical responses at all finite element model degrees of freedom. The mapping from finite element model to image is achieved using synthetic images produced by a rendering software. Finally, the technique is applied first to a synthetic deformation image, and then is validated using an experimental set of images.

47 OTHER INSTRUMENTATION↗
DOE OSTI2023

Payload concepts for investigations of electrostatic dust motion on the lunar surface

Significant experimental and computational investigations have explored the feasibility of electrostatically-motivated dust motion on the lunar surface. The motion of lunar dust influences our understanding of the evolution of the surface and may also present a hazard to future exploration vehicles and astronauts. The possibility of a sustained exploration presence on the lunar surface opens the door to long-term experiments on the lunar surface, akin to the science facilities on the International Space Station. We have identified four measurements/observations that would significantly advance our understanding of dust-plasma interactions on the lunar surface. In this context, we provide conceptual designs for payloads to obtain these observations: a Langmuir probe, dust deposit witness plate, regolith charge measurement instrument, and cameras to look for evidence of horizon glow. These payloads could deploy independently and sequentially, or together as a suite. The proposed payloads would provide key observations that would inform future modeling efforts and direct future in situ experiments to understand the dust-plasma environment, both for planetary science and spacecraft design applications.

42 ENGINEERING↗
DOE OSTI2018

Antithermal mobility in Σ7 and Σ9 grain boundaries caused by stick-slip stagnation of ordered atomic motions about Coincidence Site Lattice atoms

Antithermal grain boundary migration is an interesting phenomenon that has been recently discovered. These grain boundaries behave opposite to what is expected of thermally activated grain boundary migration; the antithermal grain boundaries exhibit mobility that decreases with increasing temperature. Two recent studies have provided insight into important behaviors correlated with antithermal migration. O'Brien and Foiles (J Mater. Sci. Vol. 51, p. 6607–6623, 2016) demonstrated that the high mobility exhibited by an antithermal Σ7 grain boundary is enabled by ordered atomic motions. Ulomek and Mohles (Acta Mater. Vol. 103, p. 424–432, 2016) demonstrated that the thermal migration of a different Σ7 grain boundary exhibited a two-step migration process. In this work, we demonstrate that the antithermal temperature dependence exhibited by these types of grain boundaries is caused by a combination of these two discoveries. Specifically, ordered atomic motions about Coincidence Site Lattice atoms (atoms common to the lattices on either side of the grain boundary), seen by O'Brien and Foiles, are interrupted by additional thermal energy at higher temperature. This is the source of the two-step process seen by Ulomek and Mohles. This two-step process is akin to stick-slip behaviors observed in shear coupled grain boundary migration. As temperature is increased, the duration of the stagnant portion increases and the mobility decreases. This behavior is demonstrated through molecular dynamics simulations in nickel bicrystals over temperatures ranging from 100 to 1400 K for Σ7 and Σ9 grain boundaries. For these Σ7 and Σ9 grain boundaries, those that have ordered atomic mechanisms are almost exclusively antithermal, while those that do not have ordered atomic mechanisms are thermally activated.

36 MATERIALS SCIENCE↗
DOE OSTI2022

The hierarchical energy landscape of screw dislocation motion in refractory high-entropy alloys

High-entropy alloys (HEAs) with concentrated solid solutions are conceived to possess a rugged atomic and energy landscape in which dislocation motion necessarily proceeds to accommodate mechanical deformation. Fundamental questions remain as to how rough the energy landscape is and to what extent it can be influenced by the local ordering of their constituent elements. Here, we construct and report the potential energy landscape (PEL) governing screw dislocation motion in refractory HEAs that reveals a hierarchical and multilevel structure with a collection of small basins nested in large metabasin. This striking feature pertaining to HEAs exerts a trapping force and back stress on saddle point activations, retarding dislocation movement. Further, by introducing chemical short-range order, the energy landscape is smoothed but skewed to different degrees that shifts the rate-liming process from kink-glide to kink-pair nucleation. The chemical disorder-roughened PEL in HEAs, analogous to structural disorder induced in metallic glasses, signifies the role of various barrier-hopping processes underlying the extraordinary mechanical behaviors of the two distinct groups of materials.

36 MATERIALS SCIENCE↗
DOE OSTI2022

A coupled vacancy diffusion-dislocation dynamics model for the climb-glide motion of jogged screw dislocations

Here, we develop a novel model to study the climb/glide motion of jogged screw dislocations within the discrete dislocation dynamics (DDD) framework. We present results for the dependence of the climb velocity on the applied stress and on the jog size and distribution statistics. We show that the model predictions are consistent with experimental data in both γ-TiAl and Zircaloy-4. The ranges of the applied stress and jog spacing that determine the dominance of one of three dislocation mechanisms are identified. These are the jog dragging, dipole dragging, and dipole bypass mechanisms, respectively. The overall dislocation motion in the jog dragging regime is composed of glide of screw segments and climb of jogs, controlling the plastic strain and the creep rate, respectively. Based on current simulations and on a detailed examination of the predicted jog heights compared to experiments, we advance the hypothesis that a combination of jog dragging and dipole bypass mechanisms is necessary to reproduce the high creep rate observed in some experiments.

36 MATERIALS SCIENCE↗
DOE OSTI2013

Quantum motion on a torus as a submanifold problem in a generalized Dirac’s theory of second-class constraints

A generalization of Dirac’s canonical quantization scheme for a system with second-class constraints is proposed, in which the fundamental commutation relations are constituted by all commutators between positions, momenta and Hamiltonian, so they are simultaneously quantized in a self-consistent manner, rather than by those between merely positions and momenta which leads to ambiguous forms of the Hamiltonian and the momenta. The application of the generalized scheme to the quantum motion on a torus leads to a remarkable result: the quantum theory is inconsistent if built up in an intrinsic geometric manner, whereas it becomes consistent within an extrinsic examination of the torus as a submanifold in three dimensional flat space with the use of the Cartesian coordinate system. The geometric momentum and potential are then reasonably reproduced. -- Highlights: •A generalization of Dirac’s canonical quantization is proposed for a system with second-class constraints. •Quantum motion on torus surface is explicitly treated to show how Schrödinger formalism is complementary to the Dirac one. •The embedding effect in quantum mechanics is originated from the quantization.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗