RNA extension drives a stepwise displacement of an initiation-factor structural module in initial transcription
Explore the source record for details and available documents.
99 GENERAL AND MISCELLANEOUS↗
SEARCH · Engineering Papers
Results for “structured”
Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.
Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.
Effects of fluorinated solvents on electrolyte solvation structures and electrode/electrolyte interphases for lithium metal batteries
Electrolyte is very critical to the performance of the high-voltage lithium (Li) metal battery (LMB), which is one of the most attractive candidates for the next generation high-density energy storage systems. Electrolyte formulation and structure determine the physical properties of the electrolytes and their interfacial chemistries on the electrode surfaces. Localized high-concentration electrolytes (LHCEs) outperform state-of-the-art carbonate electrolytes in many aspects in LMBs due to their unique solvation structure. Types of fluorinated co-solvents used in LHCEs are investigated here in searching for the most suitable diluent for high concentration electrolytes (HCEs). Non-solvating solvents (including fluorinated ethers, fluorinated borate and fluorinated orthoformate) added in HCEs enable the formation of LHCEs with high-concentration solvation structures. However, low solvating fluorinated carbonate will coordinate with Li+ ions and form a second solvation shell or a pseudo-LHCE which diminishes the benefits of LHCE. In addition, it is evident that the diluent has significant influence on the electrode/electrolyte interphases (EEIs) beyond retaining the high-concentration solvation structures. Diluent molecules surrounding the high-concentration clusters could accelerate or decelerate the anion decomposition through co-participation of diluent decomposition in the EEI formation. The varied interphase features lead to significantly different battery-performance. This study points out the importance of diluents and their synergetic effects with the conductive salt and the solvating solvent in designing LHCEs. These systematic comparisons and fundamental insights into LHCEs using different types of fluorinated solvents can guide further development of advanced electrolytes for high-voltage LMBs.
Cao, Xia↗
The myosin II coiled-coil domain atomic structure in its native environment
Explore the source record for details and available documents.
Rahmani, Hamidreza↗
High pressure structural phase transitions in Dysprosium to 202 GPa
High pressure structural phase transitions in heavy lanthanide metal Dysprosium (Dy) have been studied to 202 GPa (Volume Compression V/V 0 = 0.36) in a diamond anvil cell employing copper as an internal x-ray pressure standard. The previously assigned monoclinic (C2/m) phase above 72 GPa has been reexamined and assigned to an orthorhombic phase with sixteen atoms per cell (oF16) based on structural refinements. The equation of state is presented to 202 GPa and indicates a volume change of 2.3% during the structural phase transition from distorted face-centered cubic (hR24) phase to oF16 phase at 72 GPa. The oF16 phase can be regarded as a pseudo-orthorhombic eight-layered structure with (b/c) ratio decreasing from an ideal value of $\sqrt{3}$ with increasing pressure to 202 GPa. The ultrahigh pressure structural phases of Dy are compared with other members of the lanthanide series.
36 MATERIALS SCIENCE↗
RCSB Protein Data Bank (RCSB.org): delivery of experimentally-determined PDB structures alongside one million computed structure models of proteins from artificial intelligence/machine learning
Abstract The Research Collaboratory for Structural Bioinformatics Protein Data Bank (RCSB PDB), founding member of the Worldwide Protein Data Bank (wwPDB), is the US data center for the open-access PDB archive. As wwPDB-designated Archive Keeper, RCSB PDB is also responsible for PDB data security. Annually, RCSB PDB serves >10 000 depositors of three-dimensional (3D) biostructures working on all permanently inhabited continents. RCSB PDB delivers data from its research-focused RCSB.org web portal to many millions of PDB data consumers based in virtually every United Nations-recognized country, territory, etc. This Database Issue contribution describes upgrades to the research-focused RCSB.org web portal that created a one-stop-shop for open access to ∼200 000 experimentally-determined PDB structures of biological macromolecules alongside >1 000 000 incorporated Computed Structure Models (CSMs) predicted using artificial intelligence/machine learning methods. RCSB.org is a ‘living data resource.’ Every PDB structure and CSM is integrated weekly with related functional annotations from external biodata resources, providing up-to-date information for the entire corpus of 3D biostructure data freely available from RCSB.org with no usage limitations. Within RCSB.org, PDB structures and the CSMs are clearly identified as to their provenance and reliability. Both are fully searchable, and can be analyzed and visualized using the full complement of RCSB.org web portal capabilities.
59 BASIC BIOLOGICAL SCIENCES↗
Structure and stability of alkali gallates structurally reminiscent of hollandite
Abstract Single crystals of CsGa 7 O 11 , RbGa 7 O 11 , and RbGa 4 In 5 O 14 were grown from alkali halide melts and their structures were characterized by single crystal and powder X‐ray diffraction. CsGa 7 O 11 and RbGa 7 O 11 adopt the same structure type, reminiscent of the hollandite structure type, as it contains nearly rectangular channels made up of two dimers of edge‐sharing GaO 6 octahedra, and two corner‐sharing octahedron/tetrahedron pairs. The structure of RbGa 4 In 5 O 14 is more complex and is comprised of indium octahedra, gallium trigonal bipyramids, and gallium tetrahedra, and contains similar sized tunnels as CsGa 7 O 11 and RbGa 7 O 11 . CsGa 7 O 11 and RbGa 4 In 5 O 14 were further characterized by TGA, ion exchange experiments, and DFT studies revealing that both structures are thermodynamically stable up to 850°C; however, CsGa 7 O 11 decomposes to GaO(OH) xH 2 O when heated in warm aqueous solutions. CsGa 7 O 11 undergoes ion exchange in both an aqueous solution of RbCl and a RbNO 3 melt, as predicted by DFT studies, where the ion exchange is more extensive in the RbNO 3 melt.
Juillerat, Christian A.↗
Structural basis for selective modification of Rho and Ras GTPases by Clostridioides difficile toxin B
Toxin B (TcdB) is a primary cause of Clostridioides difficile infection (CDI). This toxin acts by glucosylating small GTPases in the Rho/Ras families, but the structural basis for TcdB recognition and selectivity of specific GTPase substrates remain unsolved. Here, we report the cocrystal structures of the glucosyltransferase domain (GTD) of two distinct TcdB variants in complex with human Cdc42 and R-Ras, respectively. These structures reveal a common structural mechanism by which TcdB recognizes Rho and R-Ras. Furthermore, we find selective clustering of adaptive residue changes in GTDs that determine their substrate preferences, which helps partition all known TcdB variants into two groups that display distinct specificities toward Rho or R-Ras. Mutations that selectively disrupt GTPases binding reduce the glucosyltransferase activity of the GTD and the toxicity of TcdB holotoxin. These findings establish the structural basis for TcdB recognition of small GTPases and reveal strategies for therapeutic interventions for CDI.
59 BASIC BIOLOGICAL SCIENCES↗
Rational Selection of Transition-Metal Oxide Electrocatalysts from Structure Electronic Structure-Activity Relations: The Role of Defects, Strain, and Sub-Surface Layering
This BES research investigates the physicochemical properties of metal oxides and how they affect electrocatalytic functionalities. The goal is to develop a predictive framework for realizing top-performing electrocatalytic materials for energy-critical reactions. The hypothesis is that well-defined thin films allow detailed mapping of structural-activity relationships because flat surfaces are more straightforward to characterize. Furthermore, the well-defined nature of thin-film metal oxides allows precise tuning of structural and chemical variables for structure-activity-relationship mapping. The proposed research has two technical objectives. The first is to experimentally assess whether the binding energies of surface oxygen can serve as an activity descriptor for oxygen electrocatalysis on metal oxides and then how to control them by tuning the structure and chemical variables. The second is to find the rate-limiting process in oxygen electrocatalysis and other small-molecule reactions. Similar mechanistic insights have been developed on well-defined platinum surfaces but not yet on oxides. This research addresses this gap and uses electrochemistry and X-ray photoemission spectroscopy to study oxide surface chemistry. The obtained insights are collectively analyzed to reveal how the oxides’ structural and chemical variables affect kinetics and can be used to design more active electrocatalysts for energy-critical reactions.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Structural cost optimization of photovoltaic central power station modules and support structure
The results of a comprehensive study of photovoltaic module structural support concepts for photovoltaic central power stations and their associated costs are presented. The objective of the study has been the identification of structural cost drivers. Parametric structural design and cost analyses of complete array systems consisting of modules, primary support structures, and foundations were performed. Area related module cost was found to be constant with design, size, and loading. A curved glass module concept was evaluated and found to have the potential to significantly reduce panel structural costs. Conclusions of the study are: array costs do not vary greatly among the designs evaluated; panel and array costs are strongly dependent on design loading; and the best support configuration is load dependent
Sutton, P. D.↗
Acoustic responses of coupled fluid-structure system by acoustic-structural analogy
The use of an analogy between structural mechanics and acoustics makes it possible to solve fluid-structural interaction (FSI) problems using an existing structural analysis computer program. This method was implemented in MSC/NASTRAN program and the FSI analysis was performed using two dimensional coupled fluid beam model to assess and evaluate the adequacy of this approach. The coupled modal analysis of 3-D model is also briefly discussed. The normal mode, modal frequency response and transient response analysis of 2-D coupled fluid beam system is presented. The significant reduction of the acoustic pressure response at the fluid structure interface is observed as a result of fluid structure interaction.
Shin, Y. S.↗
Overview of Structural Response: Probabilistic Structural Analysis
Advanced analysis methods are required to predict accurately the structural response (static, transient, cyclic, etc.) and accompanying local stresses in space propulsion system components operating in a fatigue environment consisting of complex thermal and mechanical load spectra. The probabilistic approach to structural response consists of the following program elements: (1) composite load spectra, (2) probabilistic structural analysis methods development, (3) probabilitic finite element theory, (4) probabilistic structural analysis application, (5) structural tailoring of turbopump blades, (6) unified theory of dynamic creep buckling/ratcheting, (7) creep buckling/ratcheting analyzer, and (8) nonlinear COBSTRAN development. Research activities on all of these program elements (except the creep buckling/ratcheting analyzer) are under way.
Chamis, C. C.↗
Recent advances in structural dynamics of large space structures
Recent progress in the area of structural dynamics of large space structures is reviewed. Topics include system identification, large angle slewing of flexible structures, definition of scaling limitations in structural models, and recent results on a tension-stabilized antenna concept known as the hoop-column. Increasingly complex laboratory experiments guide most of the activities leading to realistic technological developments. Theoretical progress in system identification based on system realization theory resulting in unification of several methods is reviewed. Experimental results from implementation of a theoretical large-angle slewing control approach are shown. Status and results of the development of a research computer program for analysis of the transient dynamics of large angle motion of flexible structures are presented. Correlation of results from analysis and vibration tests of the hoop-column antenna concepts are summarized.
Pinson, Larry D.↗
Lewis Structures Technology, 1988. Volume 1: Structural Dynamics
The specific purpose of the symposium was to familiarize the engineering structures community with the depth and range of research performed by the Structures Division of the Lewis Research Center and its academic and industrial partners. Sessions covered vibration control, fracture mechanics, ceramic component reliability, parallel computing, nondestructive testing, dynamical systems, fatigue and damage, wind turbines, hot section technology, structural mechanics codes, computational methods for dynamics, structural optimization, and applications of structural dynamics.
Source record↗
Recent advances in structural dynamics of large space structures
Recent progress in the area of structural dynamics of large space structures is reviewed. Topics include system identification, large angle slewing of flexible structures, definition of scaling limitations in structural models, and recent results on a tension-stabilized antenna concept known as the hoop-column. Increasingly complex laboratory experiments guide most of the activities leading to realistic technological developments. Theoretical progress in system identification based on system realization theory resulting in unification of several methods is reviewed. Experimental results from implementation of a theoretical large-angle slewing control approach are shown. Status and results of the development of a research computer program for analysis of the transient dynamics of large angle motion of flexible structures are presented. Correlation of results from analysis and vibration tests of the hoop-column antenna concept are summarized.
Pinson, Larry D.↗
Coupled fluid-thermal-structural analysis for aerodynamically heated structures
A finite element approach for integrated fluid-thermal-structural analysis of aerodynamically heated structures is described. The approach is used to solve: (1) the Navier-Stokes equations for the aerodynamic flow, (2) the energy equation of the structure for the temperature response, and (3) the quasi-static equilibrium equations of the structure for the structural response. Coupling between the three disciplines is demonstrated using two applications: Mach 7 flow over a panel and Mach 8 shock-shock interference on a cylinder.
Dechaumphai, Pramote↗
Integrated controls-structures optimization of a large space structure
A technique for the simultaneous optimization of structural and control elements of a large space structure is developed and demonstrated for a test problem, the NASA COFS-I Mast Flight System. General-purpose control and structural-analysis codes are applied directly to a large detailed model, with realistic objective and constraint functions. The steps in the process (structural optimization, control optimization, and system coordination) are described and illustrated with diagrams; the numerical implementation (using different computers for different steps) is discussed; and results showing significant design improvements in three COFS-I configurations are presented in graphs. When the weights of both structure and power-generating equipment are taken into account, a 40-bay truss design is found to be better than designs with 42 or 44 bays.
Padula, Sharon L.↗
Advanced composite structural concepts and material technologies for primary aircraft structures
Structural weight savings using advanced composites have been demonstrated for many years. Most military aircraft today use these materials extensively and Europe has taken the lead in their use in commercial aircraft primary structures. A major inhibiter to the use of advanced composites in the United States is cost. Material costs are high and will remain high relative to aluminum. The key therefore lies in the significant reduction in fabrication and assembly costs. The largest cost in most structures today is assembly. As part of the NASA Advanced Composite Technology Program, Lockheed Aeronautical Systems Company has a contract to explore and develop advanced structural and manufacturing concepts using advanced composites for transport aircraft. Wing and fuselage concepts and related trade studies are discussed. These concepts are intended to lower cost and weight through the use of innovative material forms, processes, structural configurations and minimization of parts. The approach to the trade studies and the downselect to the primary wing and fuselage concepts is detailed. The expectations for the development of these concepts is reviewed.
Jackson, Anthony↗
Inflatable structures - A concept for lunar and Martian structures
The paper discusses a modular inflatable structure concept for structures on Mars and the moon (where a human tended base will be constructed as a preliminary to a manned mission to Mars). Attention is also given to the environmental characteristics on the moon, Mars, and the earth, structural requirements for a generic structure for either moon or Mars, the moon/Mars design conditions, and the advantages of inflatable structures. Preliminary design calculations for a generic inflated module of size 6.1 x 6.1 x 3 m are presented.
Sadeh, Willy Z.↗