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At least 793 records · Page 44

Structure of nanoscale-pitch helical phases: Blue phase and twist-bend nematic phase resolved by resonant soft X-ray scattering

Periodic structures of phases with orientational order of molecules but homogenous electron density distribution: a short pitch cholesteric phase, blue phase and twist-bend nematic phase, were probed by resonant soft X-ray scattering (RSoXS) at the carbon K-edge. The theoretical model shows that in the case of a simple heliconical nematic structure, two resonant signals corresponding to the full and half pitch band should be present, while only the full pitch band is observed experimentally. This suggests that the twist-bend nematic phase has a complex structure with a double-helix built of two interlocked, shifted helices. We confirm that the helical pitch in the twist-bend nematic phase is in a 10 nm range for both the chiral and achiral materials. We also show that the symmetry of the blue phase can be unambiguously determined through a resonant enhancement of the X-ray diffraction signals, by including polarization effects, which are found to be an important indicator in phase structure determination.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Integrating high resolution drone imagery and forest inventory to distinguish canopy and understory trees and quantify their contributions to forest structure and dynamics

Tree growth and survival differ strongly between canopy trees (those directly exposed to overhead light), and understory trees. However, the structural complexity of many tropical forests makes it difficult to determine canopy positions. The integration of remote sensing and ground-based data enables this determination and measurements of how canopy and understory trees differ in structure and dynamics. Here we analyzed 2 cm resolution RGB imagery collected by a Remotely Piloted Aircraft System (RPAS), also known as drone, together with two decades of bi-annual tree censuses for 2 ha of old growth forest in the Central Amazon. We delineated all crowns visible in the imagery and linked each crown to a tagged stem through field work. Canopy trees constituted 40% of the 1244 inventoried trees with diameter at breast height (DBH) > 10 cm, and accounted for ~70% of aboveground carbon stocks and wood productivity. The probability of being in the canopy increased logistically with tree diameter, passing through 50% at 23.5 cm DBH. Diameter growth was on average twice as large in canopy trees as in understory trees. Growth rates were unrelated to diameter in canopy trees and positively related to diameter in understory trees, consistent with the idea that light availability increases with diameter in the understory but not the canopy. The whole stand size distribution was best fit by a Weibull distribution, whereas the separate size distributions of understory trees or canopy trees > 25 cm DBH were equally well fit by exponential and Weibull distributions, consistent with mechanistic forest models. The identification and field mapping of crowns seen in a high resolution orthomosaic revealed new patterns in the structure and dynamics of trees of canopy vs. understory at this site, demonstrating the value of traditional tree censuses with drone remote sensing.

59 BASIC BIOLOGICAL SCIENCES↗

Efficient identification of critical stresses in structures subject to dynamic loads

Optimum structural design problems generally employ constraints which are parametric in terms of space and time variables. A parametric constraint may be replaced by equivalent critical point constraints at its local minima for optimization applications. In complex structures, accurate identification of such critical points is computationally expensive due to the cost of finite element analyses. Three techniques are described for efficiently and accurately identifying critical points for space- and time-dependent parametric constraints. An adaptive search technique and a spline interpolation technique are developed for exactly known response. A least squares spline approximation is suggested for noisy behavior. A helicopter tail-boom structure subjected to transient loading is used as an example to demonstrate the techniques described. All three techniques are shown to be computationally efficient for critical point identification and the least squares approximation also removes noise from the data. The case of multiple constraints per element is shown to be particularly suited to the use of spline techniques.

Haftka, R. T.↗

Second Generation Integrated Composite Analyzer (ICAN) Computer Code

This manual updates the original 1986 NASA TP-2515, Integrated Composite Analyzer (ICAN) Users and Programmers Manual. The various enhancements and newly added features are described to enable the user to prepare the appropriate input data to run this updated version of the ICAN code. For reference, the micromechanics equations are provided in an appendix and should be compared to those in the original manual for modifications. A complete output for a sample case is also provided in a separate appendix. The input to the code includes constituent material properties, factors reflecting the fabrication process, and laminate configuration. The code performs micromechanics, macromechanics, and laminate analyses, including the hygrothermal response of polymer-matrix-based fiber composites. The output includes the various ply and composite properties, the composite structural response, and the composite stress analysis results with details on failure. The code is written in FORTRAN 77 and can be used efficiently as a self-contained package (or as a module) in complex structural analysis programs. The input-output format has changed considerably from the original version of ICAN and is described extensively through the use of a sample problem.

Murthy, Pappu L. N.↗

Complex collective dynamics of active torque-driven colloids at interfaces

Modern self-assembly techniques aiming to produce complex structural order or functional diversity often rely on non-equilibrium conditions in the system. Light, electric, or magnetic fields are predominantly used to modify interaction profiles of colloidal particles during self-assembly or induce complex out-of-equilibrium dynamic ordering. The energy injection rate, properties of the environment are important control parameters that influence the outcome of active (dynamic) self-assembly. The current review is focused on a case of collective dynamics and self-assembly of particles with externally driven torques coupled to a liquid or solid interface. The complexity of interactions in such systems is further enriched by strong hydrodynamic coupling between particles. Unconventionally ordered dynamic self-assembled patterns, spontaneous symmetry breaking phenomena, self-propulsion, and collective transport have been reported in torque-driven colloids. Some of the features of the complex collective behavior and dynamic pattern formation in those active systems have been successfully captured in simulations.

Snezhko, Alexey↗

The use of coherence functions to determine dynamic excitation sources on launch vehicle payloads

The problem of determining the relative contribution of simultaneous acoustic and mechanical inputs to the response of structures under combined dynamic loads was studied. An analytical technique developed by Bendat for calculating ordinary, partial, and multiple coherence functions, using an iterative nonmatrix approach was applied to data obtained from laboratory tests on a complex structural assembly. Testing was performed in an acoustically 'live' room. Up to three random inputs, having similar spectral content and varying degrees of mutual coherence, and a single output were used. Stationary and nonstationary inputs were used. It was concluded that the technique provided an effective method of identifying sources of dynamic excitation and evaluating their relative contributions to the measured output at structural resonances, for stationary random inputs. An attempt to apply the technique to nonstationary inputs did not yield consistent results.

Barrett, S.↗

Reversible hierarchical structure induced by solvation and temperature modulation in an ionic liquid-based random bottlebrush copolymer

Here a solvent and temperature responsive random copolymer having a polyacrylate backbone with emanating ionic liquid side chains of 1-decyl-3-methylimidazolium chloride and 1-(2-carboxyethyl)-3-imidazolium bromide grafted poly-N-isopropylacrylamide (PNIPAM) possessing bottlebrush architecture is synthesized. The bottlebrush copolymer is prepared using an uncommon route that exploits the co-assembly of two amphiphilic ionic liquid acryloyl-based monomers in 30% (w/w) water to form a lyotropic mesophase followed by photo-initiated free radical polymerization. The copolymer adopts a temperature-invariant 2D hexagonal structure as determined by SAXS in the dehydrated (de-swollen) state. The absence of thermoresponsivity is attributed to a combination of confinement coupled with insufficient solvation of the grafted PNIPAM chains. In a water-swollen state (hydrogel), loss in long range translational ordering is observed while short range temperature-dependent ordering dominates. Below the LCST of PNIPAM (<40 °C), disassociated nanoscale discoidal assemblies predominate, as determined by SAXS. At temperatures above the LCST, the particles condense to form thicker circular discs of similar diameter. Polarized optical microscopy shows the formation of 1-D liquid-crystalline fibrillar structures spanning the meso- to micro-length scales. The assembly and disassembly are fully reversible with temperature cycling. Finally, this work demonstrates the possibility of achieving self-organization over multiple length scales (panoscopic) to create complex structures from modular components using an external stimulus to control construction.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Putative rhamnogalacturonan-II glycosyltransferase identified through callus gene editing bypasses embryo lethality

Rhamnogalacturonan II (RG-II) is a structurally complex and conserved domain of the pectin present in the primary cell walls of vascular plants. Borate crosslinking of RG-II is required for plants to grow and develop normally. Mutations that alter RG-II structure also affect crosslinking and are lethal or severely impair growth. Thus, few genes involved in RG-II synthesis have been identified. Here we developed a method to generate viable loss-of-function Arabidopsis (Arabidopsis thaliana) mutants in callus tissue via CRISPR/Cas9-mediated gene editing. We combined this with a candidate gene approach to characterize the male gametophyte defective 2 (MPG2) gene that encodes a putative family GT29 glycosyltransferase. Plants homozygous for this mutation do not survive. We showed that in the callus mutant cell walls, RG-II does not crosslink normally because it lacks 3-deoxy-D-manno-octulosonic acid (Kdo) and thus cannot form the α-L-Rhap-(1→5)-α-D-kdop-(1→ sidechain. We suggest that MGP2 encodes an inverting RG-II CMP-β-Kdo transferase (RCKT1). Our discovery provides further insight into the role of sidechains in RG-II dimerization. Our method also provides a viable strategy for further identifying proteins involved in the biosynthesis of RG-II.

59 BASIC BIOLOGICAL SCIENCES↗

Displacement based multilevel structural optimization

Multidisciplinary design optimization (MDO) is expected to play a major role in the competitive transportation industries of tomorrow, i.e., in the design of aircraft and spacecraft, of high speed trains, boats, and automobiles. All of these vehicles require maximum performance at minimum weight to keep fuel consumption low and conserve resources. Here, MDO can deliver mathematically based design tools to create systems with optimum performance subject to the constraints of disciplines such as structures, aerodynamics, controls, etc. Although some applications of MDO are beginning to surface, the key to a widespread use of this technology lies in the improvement of its efficiency. This aspect is investigated here for the MDO subset of structural optimization, i.e., for the weight minimization of a given structure under size, strength, and displacement constraints. Specifically, finite element based multilevel optimization of structures (here, statically indeterminate trusses and beams for proof of concept) is performed. In the system level optimization, the design variables are the coefficients of assumed displacement functions, and the load unbalance resulting from the solution of the stiffness equations is minimized. Constraints are placed on the deflection amplitudes and the weight of the structure. In the subsystems level optimizations, the weight of each element is minimized under the action of stress constraints, with the cross sectional dimensions as design variables. This approach is expected to prove very efficient, especially for complex structures, since the design task is broken down into a large number of small and efficiently handled subtasks, each with only a small number of variables. This partitioning will also allow for the use of parallel computing, first, by sending the system and subsystems level computations to two different processors, ultimately, by performing all subsystems level optimizations in a massively parallel manner on separate processors. It is expected that the subsystems level optimizations can be further improved through the use of controlled growth, a method which reduces an optimization to a more efficient analysis with only a slight degradation in accuracy. The efficiency of all proposed techniques is being evaluated relative to the performance of the standard single level optimization approach where the complete structure is weight minimized under the action of all given constraints by one processor and to the performance of simultaneous analysis and design which combines analysis and optimization into a single step. It is expected that the present approach can be expanded to include additional structural constraints (buckling, free and forced vibration, etc.) or other disciplines (passive and active controls, aerodynamics, etc.) for true MDO.

Striz, Alfred G.↗

High throughput automated characterization of enamel microstructure using synchrotron tomography and optical flow imaging

The remarkable damage-tolerance of enamel has been attributed to its hierarchical microstructure and the organized bands of decussated rods. A thorough characterization of the microscale rod evolution within the enamel is needed to elucidate this complex structure. While prior efforts in this area have made use of single particle tracking to track a single rod evolution to various degrees of success, such a process can be both computationally and labor intensive, limited to the evolution path of a single rod, and is therefore prone to error from potentially tracking outliers. Particle image velocimetry (PIV) is a well-established algorithm to derive field information from image sequences for processes that are time-dependent, such as fluid flows and structural deformation. In this work, we demonstrate the use of PIV in extracting the full-field microstructural distribution of rods within the enamel. Further, enamel samples from a wild African lion were analyzed using high-energy synchrotron X-ray micro-tomography. Results from the PIV analysis provide sufficient full-field information to reconstruct the growth of individual rods that can potentially enable rapid analysis of complex microstructures from high resolution synchrotron datasets. Such information can serve as a template for designing damage-tolerant bioinspired structures for advanced manufacturing.

36 MATERIALS SCIENCE↗

Three-Dimensional Electrical Resistivity Tomography of the Solfatara Crater (Italy): Implication for the Multiphase Flow Structure of the Shallow Hydrothermal System: Resistivity Model of Solfatara Crater

The Solfatara volcano is the main degassing area of the Campi Flegrei caldera, characterized by 30 of unrest. Assessing and understanding such renewal activity is a challenging task because hydrothermal interactions with magmatic gases remain poorly understood. In this study, we decipher the complex structure of the shallow Solfatara hydrothermal system by performing the first 3-D, high-resolution, Electrical Resistivity Tomography (ERT) of the volcano. The 3-D resistivity model was obtained from the inversion of 43,432 resistance measurements performed on an area of 0.68 km 2 . The proposed interpretation of the multiphase hydrothermal structures is based on the resistivity model, a high-resolution infrared surface temperature image, and 1,136 soil CO 2 flux measurements. In addition, we realized 27 soil Cation Exchange Capacity (CEC) and pH measurements demonstrating a negligible contribution of surface conductivity to the shallow bulk electrical conductivity. Hence, we demonstrate that the resistivity changes are mainly controlled by fluid content and temperature. The high-resolution tomograms identify for the first time the structure of the gas-dominated reservoir at 50 m depth that feeds the Bocca Grande fumarole through a ~10-m-thick channel. In addition, the resistivity model reveals a channel-like conductive structure where the liquid produced by steam condensation around the main fumaroles flows down to the Fangaia area within a buried fault. The model delineates the emplacement of the main geological structures: Mt Olibano, Solfatara crypto-dome, and tephra deposits. It also reveals the anatomy of the hydrothermal system, especially two liquid-dominated plumes, the Fangaia mud pool and the Pisciarelli fumarole, respectively.

58 GEOSCIENCES↗

Bilayer Metasurfaces for Dual- and Broadband Optical Antireflection

Optical antireflection has long been pursued for a wide range of applications, but existing approaches encounter issues in the performance, bandwidth, and structure complexity, particularly in the long-wavelength infrared regime. Here we present the demonstration of bilayer metasurfaces that accomplish dual- and broadband optical antireflection in the terahertz and mid-infrared spectral ranges. Furthermore, by simply tailoring the structural geometry and dimensions, here we show that subwavelength metal/dielectric structures enable dramatic reduction of Fresnel reflection and significant enhancement of transmission at a substrate surface, operating either at two discrete narrow bands or over a broad bandwidth up to 28%. We also use a semianalytical interference model to interpret the obtained results, in which we find that the dispersion of the constituent structures plays a critical role in achieving the observed broadband optical antireflection.

36 MATERIALS SCIENCE↗

Nanofabrication of synthetic nanoporous geomaterials: from nanoscale-resolution 3D imaging to nano-3D-printed digital (shale) rock

Abstract Advances in imaging have made it possible to view nanometer and sub-nanometer structures that are either synthesized or that occur naturally. It is believed that fluid dynamic and thermodynamic behavior differ significantly at these scales from the bulk. From a materials perspective, it is important to be able to create complex structures at the nanometer scale, reproducibly, so that the fluid behavior may be studied. New advances in nanoscale-resolution 3D-printing offer opportunities to achieve this goal. In particular, additive manufacturing with two-photon polymerization allows creation of intricate structures. Using this technology, a creation of the first nano-3D-printed digital (shale) rock is reported. In this paper, focused ion beam-scanning electron microscopy (FIB-SEM) nano-tomography image dataset was used to reconstruct a high-resolution digital rock 3D model of a Marcellus Shale rock sample. Porosity of this 3D model has been characterized and its connected/effective pore system has been extracted and nano-3D-printed. The workflow of creating this novel nano-3D-printed digital rock 3D model is described in this paper.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

The Detection of Monoclinic Zirconia and Non-Uniform 3D Crystallographic Strain in a Re-Oxidized Ni-YSZ Solid Oxide Fuel Cell Anode

The solid oxide fuel cell (SOFC) anode is often composed of nickel (Ni) and yttria-stabilized zirconia (YSZ). The yttria is added in small quantities (e.g., 8 mol %) to maintain the crystallographic structure throughout the operating temperatures (e.g., room-temperature to >800 °C). The YSZ skeleton provides a constraining structural support that inhibits degradation mechanisms such as Ni agglomeration and thermal expansion miss-match between the anode and electrolyte layers. Within this structure, the Ni is deposited in the oxide form and then reduced during start-up; however, exposure to oxygen (e.g., during gasket failure) readily re-oxidizes the Ni back to NiO, impeding electrochemical performance and introducing complex structural stresses. In this work, we correlate lab-based X-ray computed tomography using zone plate focusing optics, with X-ray synchrotron diffraction computed tomography to explore the crystal structure of a partially re-oxidized Ni/NiO-YSZ electrode. These state-of-the-art techniques expose several novel findings: non-isotropic YSZ lattice distributions; the presence of monoclinic zirconia around the oxidation boundary; and metallic strain complications in the presence of variable yttria content. This work provides evidence that the reduction–oxidation processes may destabilize the YSZ structure, producing monoclinic zirconia and microscopic YSZ strain, which has implications upon the electrode’s mechanical integrity and thus lifetime of the SOFC.

25 ENERGY STORAGE↗

Midlatitude sporadic-E layers

Rocket borne probes and incoherent scatter radar were demonstrated to be effective methods of studying the structure of midlatitude sporadic E layers. Layers are formed when metal ions are converged vertically in a wind shear to produce a local enhancement of electron density. Rocket and radar observations show that the layers may occassionally have complex structure produced by an unstable wind shear. The partial transparency to radio waves of sporadic E layers is shown to be due to localized regions of high electron density.

Smith, L. G.↗

Directional Charge Separation in Isolated Organic Semiconductor Crystalline Nanowires

This research program was focused on development of new material platforms and analytical spectroscopy methodologies for probing inter- and intra-molecular electronic processes in conjugated nanomaterials. A detailed understanding of the connection between molecular architecture, supramolecular/polymer assembly, and optoelectronic function is critical to the improvement in polymer-based optoelectronics, yet many questions remain outstanding as to how to ‘program’ specific inter-molecular couplings via molecular structure in order to achieve desired device performance (photostability, chargeseparation and charge-transport efficiency). We combine single-molecule spectroscopy tools and new synthetic methodologies to probe intra- and inter-molecular coupling in small-molecule, oligomeric complex structures and crystalline nanoscale supramolecular assemblies in order to understand in detail, the structure-excitonic property relations and elucidate molecular design rules (distances, angles, etc) for improved performance in organic optoelectronics.

36 MATERIALS SCIENCE↗

Hubble Space Telescope images and follow-up spectroscopy of the Orion nebula

Recently published HST images of the Orion nebula reveal elephant-trunk structures, an apparent jet of material, and fine-scale structure in the Herbig-Haro object HH2, which is located at the base of an elephant trunk. High-resolution spectroscopy shows that the apparent jet is actually an ionization front seen edge-on. HH2 shows a complex structure in the several stages of ionization observed. There seem to be two velocity systems characterized by a bright central region and an accompanying shell-like emission. These two systems are most likely to be the result of a bow shock and corresponding Mach disk formed from the interaction of a collimated jet and the ambient gas of the nebula.

O'Dell, C. R.↗