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At least 991 records · Page 55
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Flower-shaped 2D crystals grown in curved fluid vesicle membranes

Abstract The morphologies of two-dimensional (2D) crystals, nucleated, grown, and integrated within 2D elastic fluids, for instance in giant vesicle membranes, are dictated by an interplay of mechanics, permeability, and thermal contraction. Mitigation of solid strain drives the formation of crystals with vanishing Gaussian curvature (i.e., developable domain shapes) and, correspondingly, enhanced Gaussian curvature in the surrounding 2D fluid. However, upon cooling to grow the crystals, large vesicles sustain greater inflation and tension because their small area-to-volume ratio slows water permeation. As a result, more elaborate shapes, for instance, flowers with bendable but inextensible petals, form on large vesicles despite their more gradual curvature, while small vesicles harbor compact planar crystals. This size dependence runs counter to the known cumulative growth of strain energy of 2D colloidal crystals on rigid spherical templates. This interplay of intra-membrane mechanics and processing points to the scalable production of flexible molecular crystals of controllable complex shape.

36 MATERIALS SCIENCE↗
DOE OSTI2024

In-beam spectroscopy reveals competing nuclear shapes in the rare isotope 62 Cr

In recent decades, rareisotope facilities have enabled the study of short-lived, neutron-rich nuclei. Their measured properties indicate that shell structure changes in the regime of unbalanced neutron-to-proton ratios compared to that of stable nuclei. In the so-called islands of inversion in the nuclear chart – around the neutron-rich nuclei 32 Mg, 42 Si and 64 Cr, for example – the textbook shell-model picture predicts the presence of spherical shapes due to the respective magic neutron numbers of 20, 28, and 40 of these nuclei. However, nuclei in these regions turn out to be deformed in their ground states. Another hallmark of these islands is shape coexistence, where a nucleus assumes different shapes with excitation energy. Furthermore, we present evidence for this phenomenon from the observation of an excited 0 + state in 62 Cr, two neutrons away from the heart of the island of inversion around neutron number N = 40. We use large-scale shell-model calculations to interpret the results and report extrapolations for the doubly-magic nucleus 60 Ca.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2025

Shape-anisotropy inverses the behavior of emergent vortices in active chiral fluids

Active colloidal fluids exhibit spontaneous emergence of correlated states, characterized by complex collective dynamics and self-organization. In geometrically confined systems, activity modulations trigger robust polar state reversals of a macroscopic vortex formed by colloidal rollers. Here, we reveal that the shape anisotropy of dielectric rollers transforms the system into a chiral active fluid comprised of rollers of arbitrary handedness. The chiral rollers self-assemble into multiple freestanding vortices with a spontaneously selected sense of rotation. We demonstrate that upon reactivation of the system after a complete cessation of activity beyond all relevant timescales, the vortices simultaneously restore their previous chiral states in striking contrast to the chiral state reversals demonstrated by spherical rollers. The analysis reveals that shape-anisotropy modifies the collective state memory of the ensemble. The findings provide insights into the emergence of complex collective behavior in chiral colloidal fluids governed by an interplay between shape anisotropy, chiral motion, and activity modulations.

Colloids↗
DOE OSTI2014

Non-Reciprocal Geometric Wave Diode by Engineering Asymmetric Shapes of Nonlinear Materials

Unidirectional nonreciprocal transport is at the heart of many fundamental problems and applications in both science and technology. Here we study the novel design of wave diode devices by engineering asymmetric shapes of nonlinear materials to realize the function of non-reciprocal wave propagations. We first show analytical results revealing that both nonlinearity and asymmetry are necessary to induce such non-reciprocal (asymmetric) wave propagations. Detailed numerical simulations are further performed for a more realistic geometric wave diode model with typical asymmetric shape, where good non-reciprocal wave diode effect is demonstrated. Finally, we discuss the scalability of geometric wave diodes. The results open a flexible way for designing wave diodes efficiently simply through shape engineering of nonlinear materials, which may find broad implications in controlling energy, mass and information transports.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2012

UV patternable thin film chemistry for shape and functionally versatile self-oscillating gels

We describe a new planar processing chemistry that allows the synthesis and patterning of dynamically self-actuating gels of diverse form. The chemical reaction covalently incorporates a methacrylate-modified ruthenium trisbipyridine monomer within a poly acrylamide (PAAm) gel, modified to provide a flexible chemistry for UV-curable, self-oscillating Belousov–Zhabotinsky (BZ) gels. The photoinitiated polymerization offers significant advantages over previously reported BZ gel chemistries – fast polymerization rates, broad flexibility in the structural and functional attributes that impact the BZ reaction driven mechanics, and a facility for net shape fabrication via projection mode photo lithographic exposure. The facility of the synthetic method enabled an opportunity to broadly explore the structure/property and structure/rate correlations characterizing the dynamics of these gels and develop means to both control and predict the detailed features of the self-oscillating chemical waves they embed. The PAAm systems initiate under the control of transport-dominated influences weighted heavily by the diffusion/depletion of reagents present in the ambient contacting fluid medium. These initiating modes of oscillation are generally unstable temporally, showing shape- and property-sensitive conversions to oscillating modes controlled by the attributes of the gel-phase environment. The present work establishes the nature of these sensitivities, developing insights related to such features in patterned gel objects or films as composition, size, thickness, shape, degree of crosslinking, and gradient forms of structure within the gel. We observed in this work that, across a broad design-rule and compositional space, the PAAm based BZ gel systems exhibit contractions in dimension for regions in which the Ru catalyst is present in the +3 oxidation state (PNIPAAm BZ gels expand in this state). The chemomechanics of the PAAm system are further differentiated from those of PNIPAAm in the generally (and relatively) fast oscillatory rates it can sustain. Furthermore, this work suggests the dynamics in the PAAm gels do not reflect a simple osmotic force driven by differences in the solvation of Ru(II/III) centers. Computational modeling supports a mechanism in which the charge state of Ru centers mediate a differential degree of intra/inter-chain segmental interactions – dynamics that mediate a temporally varying degree of reversibly formed association crosslinks within the gel.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Self-assembly of trimer colloids: effect of shape and interaction range

Trimers with one attractive bead and two repulsive beads, similar to recently synthesized trimer patchy colloids, were simulated with flat-histogram Monte Carlo methods to obtain the stable self-assembled structures for different shapes and interaction potentials. Extended corresponding states principle was then successfully applied to self-assembling systems in order to approximately collapse the results for models with the same shape, but different interaction range. This helps us directly compare simulation results with previous experiment, and good agreement was found between the two. In addition, a variety of self-assembled structures were observed by varying the trimer geometry, including spherical clusters, elongated clusters, monolayers, and spherical shells. In conclusion, our results help to compare simulations and experiments, via extended corresponding states, and we predict the formation of self-assembled structures for trimer shapes that have not been experimentally synthesized.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Programmable shape transformation of elastic spherical domes

We investigate mismatch strain driven programmable shape transformation of spherical domes and report the effects of different geometric and structural characteristics on dome behavior in response to applied mismatch strain. We envision a bilayer dome design where the differential swelling of the inner layer with respect to the passive outer layer in response to changes in dome surroundings (such as the introduction of an organic solvent) introduces mismatch strain within the bilayer system and causes dome shape transformation. Finite element analysis reveals that, in addition to snap-through, spherical domes undergo bifurcation buckling and eventually gradual bending to morph into cylinders with increasing mismatch strain. Besides demonstrating how the snap-through energy barrier depends on the spherical dome shape, our analysis identifies three distinct groups of dome geometries based on their mismatch strain-transformed configuration relationships. Our experiments with polymer-based elastic bilayer domes that exhibit differential swelling in organic solvents qualitatively confirm the finite element predictions. We establish that, in addition to externally applied stimuli (mismatch strain), bilayer spherical dome morphing can be tuned and hence programmed through its geometry and structural characteristics. Incorporation of an elastic instability mechanism such as snap-through within the framework of stimuli-responsive functional devices can improve their response time which is otherwise controlled by diffusion. Furthermore, our proposed design guidelines can be used to realize deployable, multi-functional, reconfigurable, and therefore, adaptive structures responsive to a diverse set of stimuli across multiple length scales.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Catastrophic depolymerization of microtubules driven by subunit shape change

We report that microtubules exhibit a dynamic instability between growth and catastrophic depolymerization. GTP-tubulin (αβ-dimer bound to GTP) self-assembles, but dephosphorylation of GTP- to GDP-tubulin within the tubule results in destabilization. While the mechanical basis for destabilization is not fully understood, one hypothesis is that dephosphorylation causes tubulin to change shape, frustrating bonds and generating stress. To test this idea, we perform molecular dynamics simulations of microtubules built from coarse-grained models of tubulin, incorporating a small compression of α-subunits associated with dephosphorylation in experiments. We find that this shape change induces depolymerization of otherwise stable systems via unpeeling “ram's horns” characteristic of microtubules. Depolymerization can be averted by caps with uncompressed α-subunits, i.e., GTP-rich end regions. Thus, the shape change is sufficient to yield microtubule behavior.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

Ion beam-induced bending of TiO 2 nanowires with bead-like and prismatic shapes

Ion beam irradiation is a promising method to manipulate the composition and shape of nanowires. It causes the formation of crystal defects like vacancies and dislocations, and consequently, a volume expansion within the irradiated region, giving rise to the nanowire bending. The bending effect has been extensively discussed within nanowires with different diameters under ion beams with varying energies and ion fluences. However, the behaviors of nanowires with complicated shapes, which may have non-uniform irradiated regions due to the changing angle of incidence and shadowing effect, have remained largely unknown. Herein, the structural changes and bending of TiO 2 nanowires with both bead-like and prismatic shapes are investigated under a Ga + ion beam. The multi-faceted morphology, and consequently, varying angles of incidence, result in inhomogeneous irradiation and volume expansion. As a result, significant bending is only observed in prismatic nanowires. Since irradiation is confined within the half of nanowires facing the ion beam, the bending of nanowires is reversible by changing the direction of the ion beam. In order to provide insights into the tailoring composition and morphology of nanowires, we anticipate that this finding can establish the beam analog at the nanoscale, the bending of which can be tuned by ion irradiation.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Understanding the Effect of Chiral NN Parametrization on Nuclear Shapes From an Ab Initio Perspective

The ab initio symmetry-adapted no-core shell model naturally describes nuclear deformation and collectivity, and is therefore well-suited to studying the dynamics and coexistence of shapes in atomic nuclei. For the first time, we analyze how these features in low-lying states of 6 Li and 12 C are impacted by the underlying realistic nucleon-nucleon interaction. We find that the interaction parametrization has a notable but limited effect on collective shapes in the lowest 6 Li and 12 C states, while collective structures in the excited 2 + state of 12 C are significantly more sensitive to the interaction parameters and exhibits emergent shape coexistence.

Becker, Kevin S. [Louisiana State University, Bato↗
DOE OSTI2012

Extracting core shape from x-ray images at the National Ignition Facility

Measuring the shape of implosions is critical to inertial confinement fusion experiments at the National Ignition Facility. We have developed techniques that have proven successful for extracting shape information from images of x-ray self-emission recorded by a variety of diagnostic instruments for both DT-filled targets and low-yield surrogates. These key results help determine optimal laser and target parameters leading to ignition. We have compensated for instrumental response and have employed a variety of image processing methods to remove artifacts from the images while retaining salient features. The implosion shape has been characterized by decomposing intensity contours into Fourier and Legendre modes for different lines of sight. We also describe procedures we have developed for estimating uncertainties in these measurements.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2012

Role of B19' martensite deformation in stabilizing two-way shape memory behavior in NiTi

Deformation of a B19' martensitic, polycrystallineNi49.9Ti50.1 (at. %) shape memoryalloy and its influence on the magnitude and stability of the ensuing two-way shape memory effect (TWSME) was investigated by combined ex situ mechanical experimentation and in situneutron diffraction measurements at stress and temperature. The microstructural changes (texture, lattice strains, and phase fractions) during room-temperature deformation and subsequent thermal cycling were captured and compared to the bulk macroscopic response of the alloy. With increasing uniaxial strain, it was observed that B19' martensite deformed by reorientation and detwinning with preferred selection of the (1¯50) M and (010) M variants, (201¯) B19' deformation twinning, and dislocation activity. These mechanisms were indicated by changes in bulk texture from the neutron diffraction measurements. Partial reversibility of the reoriented variants and deformation twins was also captured upon load removal and thermal cycling, which after isothermal deformation to strains between 6% and 22% resulted in a strong TWSME. Consequently, TWSME functional parameters including TWSME strain, strain reduction, and transformation temperatures were characterized and it was found that prior martensite deformation to 14% strain provided the optimum condition for the TWSME, resulting in a stable two-way shape memory strain of 2.2%. Thus, isothermal deformation of martensite was found to be a quick and efficient method for creating a strong and stable TWSME in Ni₄₉.₉Ti₅₀.₁.

Benafan, O.↗
DOE OSTI2012

Adjustment of ablation shapes and subwavelength ripples based on electron dynamics control by designing femtosecond laser pulse trains

A quantum model is proposed to investigate femtosecond laser pulse trains processing of dielectrics by including the plasma model with the consideration of laser particle-wave duality. Central wavelengths (400 nm and 800 nm) strongly impact the surface plasmon field distribution, the coupling field intensity distribution (between the absorbed intensity and the surface plasma), and the distribution of transient localized free electron density in the material. This, in turn, significantly changes the localized transient optical/thermal properties during laser materials processing. The effects of central wavelengths on ablation shapes and subwavelength ripples are discussed. The simulation results show that: (1) ablation shapes and the spacing of subwavelength ripples can be adjusted by localized transient electron dynamics control using femtosecond laser pulse trains; (2) the adjustment of the radii of ablation shapes is stronger than that of the periods of subwavelength ripples.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2013

Criteria of radio-frequency ring-shaped hollow cathode discharge using H{sub 2} and Ar gases for plasma processing

In order to achieve high-density capacitively coupled plasma, a radio-frequency (RF) ring-shaped hollow cathode discharge has been developed as a candidate for processing plasma sources. The plasma density in the hollow cathode discharge reaches a high magnitude of 10{sup 10}-10{sup 11} cm{sup -3}. The RF ring-shaped hollow cathode discharge depends on the pressure and mass of the working gas. Criteria required for producing a RF ring-shaped hollow cathode discharge have been investigated for various gas pressures using H{sub 2} and Ar gases for high-density plasma production. The results reveal that the criteria for the occurrence of the hollow cathode effect are that the trench width should be approximately equal to the sum of the electron-neutral mean free paths and twice the sheath thickness of the RF powered electrode.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2013

Nanoimprint-lithography patterned epitaxial Fe nanowire arrays with misaligned magnetocrystalline and shape anisotropies

We fabricated large area (>1 × 1 cm 2 ), epitaxial Fe nanowire arrays on MgO(001) substrates by nanoimprint lithography with a direct metallization of epitaxial materials through a metallic mask, which avoided the disadvantageous metal-etching process in conventional methods. The magnetization reversals, as revealed by magneto-optic Kerr effect, showed competing effects between Fe cubic magnetocrystalline anisotropy and lithographically induced uniaxial shape anisotropy. Unlike the weakly induced uniaxial anisotropy observed in continuous films, both the magnitude and direction of the uniaxial shape anisotropy can be easily modulated in the nanowires. Complex magnetization reversal processes including two-step and three-step loops were observed when magnetizing the samples along different Fe cubic easy axes, respectively. Finally, these modified magnetization reversal processes were explained by the nucleation and propagation of the domain walls along the non-superimposed easy axes of the competing magnetocrystalline and shape anisotropies.

Environmental Molecular Sciences Laboratory↗
DOE OSTI2014

Improvement of uniformity of the negative ion beams by tent-shaped magnetic field in the JT-60 negative ion source

Non-uniformity of the negative ion beams in the JT-60 negative ion source with the world-largest ion extraction area was improved by modifying the magnetic filter in the source from the plasma grid (PG) filter to a tent-shaped filter. The magnetic design via electron trajectory calculation showed that the tent-shaped filter was expected to suppress the localization of the primary electrons emitted from the filaments and created uniform plasma with positive ions and atoms of the parent particles for the negative ions. By modifying the magnetic filter to the tent-shaped filter, the uniformity defined as the deviation from the averaged beam intensity was reduced from 14% of the PG filter to ∼10% without a reduction of the negative ion production.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2013

Effects of electric field and shape on the ground state energy of an exciton bound to an ionized donor impurity in ellipsoidal quantum dots

The effects of electric field and shape on the ground state energy of an exciton bound to an ionized donor are studied in a weakly prolate (oblate) GaAs ellipsoidal quantum dot within the effective-mass approximation using a variational method in the framework of perturbation theory. Both the heavy-hole and light-hole excitons are considered. The results show that the energy shift not only depends on the electric field but also on the dot shape and size. The influence of the dot shape on the light hole case is more pronounced than that of the heavy hole case, but the influence of the electric field on the heavy hole case is more pronounced.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2013

A first look at Weyl anomalies in shape dynamics

One of the more popular objections towards shape dynamics is the suspicion that anomalies in the spatial Weyl symmetry will arise upon quantization. The purpose of this short paper is to establish the tools required for an investigation of the sort of anomalies that can possibly arise. The first step is to adapt to our setting Barnich and Henneaux's formulation of gauge cohomology in the Hamiltonian setting, which serve to decompose the anomaly into a spatial component and time component. The spatial part of the anomaly, i.e., the anomaly in the symmetry algebra itself ([Ω, Ω] ∝ ℏ instead of vanishing) is given by a projection of the second ghost cohomology of the Hamiltonian BRST differential associated to Ω, modulo spatial derivatives. The temporal part, [Ω, H] ∝ ℏ is given by a different projection of the first ghost cohomology and an extra piece arising from a solution to a functional differential equation. Assuming locality of the gauge cohomology groups involved, this part is always local. Assuming locality for the gauge cohomology groups, using Barnich and Henneaux's results, the classification of Weyl cohomology for higher ghost numbers performed by Boulanger, and following the descent equations, we find a complete characterizations of anomalies in 3+1 dimensions. The spatial part of the anomaly and the first component of the temporal anomaly are always local given these assumptions even in shape dynamics. The part emerging from the solution of the functional differential equations explicitly involves the shape dynamics Hamiltonian, and thus might be non-local. If one restricts this extra piece of the temporal anomaly to be also local, then overall no Weyl anomalies, either temporal or spatial, emerge in the 3+1 case.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗