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At least 1,135 records · Page 63

The 12 - 24-day mode of global precipitation

Global precipitation estimates derived from satellite data at the Goddard Laboratory for Atmospheres for 1979-80 were used to explore time variations in global precipitation. Time series of the area-averaged precipitation (P) over the Asian-Australian (AA) monsoon (60 deg E - 120 deg W), and the extra-AA monsoon (120 deg W - 60 deg E) hemispheres were used in describing the variations. A distinct seesawlike intraseasonal variation of precipitation between these two hemispheres emerges from the two time series. Two intraseasonal (30 - 60 and 12 - 24 day) modes stand out in the spectral analysis of the two (P) time series. The 30 - 60-day mode is well known, while the 12 - 14-day mode is identified here for the first time. Using data generated by the Global Data Assimilation System of the National Meteorological Center, an effort was made to investigate the characteristics of the 12 - 14-day mode of global precipitation via potential functions for the 200-mb wind, water vapor transport, and precipitation. It is found that the 12 - 24-day mode exhibits a wavenumber 1 structure and propagates eastward. The seesaw intraseasonal variation of precipitation between the AA and extra-AA monsoon hemispheres is caused not only by the 30 - 60-day mode but also by the 12 - 24-day mode.

Chen, Tsing-Chang↗

Non-Solvent Induced Phase Separation Enables Designer Redox Flow Battery Electrodes

Porous carbonaceous electrodes are performance-defining components in redox flow batteries (RFBs), where their properties impact the efficiency, cost, and durability of the system. The overarching challenge is to simultaneously fulfill multiple seemingly contradictory requirements—i.e., high surface area, low pressure drop, and facile mass transport—without sacrificing scalability or manufacturability. Here, non-solvent induced phase separation (NIPS) is proposed as a versatile method to synthesize tunable porous structures suitable for use as RFB electrodes. The variation of the relative concentration of scaffold-forming polyacrylonitrile to pore-forming poly(vinylpyrrolidone) is demonstrated to result in electrodes with distinct microstructure and porosity. Tomographic microscopy, porosimetry, and spectroscopy are used to characterize the 3D structure and surface chemistry. Flow cell studies with two common redox species (i.e., all-vanadium and Fe2+/3+) reveal that the novel electrodes can outperform traditional carbon fiber electrodes. It is posited that the bimodal porous structure, with interconnected large (>50 µm) macrovoids in the through-plane direction and smaller (<5 µm) pores throughout, provides a favorable balance between offsetting traits. Although nascent, the NIPS synthesis approach has the potential to serve as a technology platform for the development of porous electrodes specifically designed to enable electrochemical flow technologies.

36 MATERIALS SCIENCE↗

Observational evidence and dynamical interpretation of the total ozone variations in the equatorial region

The total ozone amount is sensitive to the general circulation changes in the lower stratosphere due to the photochemically inactive nature of ozone there. In the equatorial region, such circulation changes arise from the quasi-biennial oscillation (QBO) of the stratospheric zonal wind and the El Nino/Southern Oscillation (ENSO). In the first half of this study we present observational results of the long-term variations in the equatorial ozone field using the 11 year Total Ozone Mapping Spectrometer (TOMS) data, by paying special attention to the longitudinal structure. In the latter half we try to understand quantitatively these variations by using a simple mechanistic relationship. We hypothesis that the ozone modulating processes are attributable to two dynamical effects, the advection effect and tropopause effect, owing to the strong vertical stratification of ozone existing just above the tropopause. The advection effect comes from the vertical motion which maintains the temperature structure, compensating for the radiative damping. The tropopause effect is associated with the altitude change of the tropopause. The total ozone variations in the tropics is discussed in terms of these two dynamical processes with the aid of mechanistic equations combined with the wind and sea surface temperature (SST) observations. The interactions between tropical and extratropical latitudes are beyond the scope of this study. Photochemical effects are also neglected. Details of this study are given by Shiotani (1992) and Hasebe (1992).

Shiotani, Masato↗

A first look at atmospheric dynamics and temperature variations on Titan.

Pollack (1973) has used a radiative equilibrium model to match radiometric data for Titan and infers the atmospheric mass, composition, opacity, and gross vertical thermal structure. These results are used to estimate the atmospheric temperature variations by means of scaling analysis, taking into account dynamics both for a baroclinic wave regime and for an axially symmetric circulation regime. Horizontal temperature variations of the atmosphere and surface are found to be very small, and the circulation is found to be weak and probably axially symmetric. The small temperature variations appear to preclude the storage of volatiles in polar caps, so that the present atmospheric methane content may be due to a balance between outgassing and photodissociation.

Leovy, C. B.↗

Tuning the structure and superconductivity of SrNi 2⁢ P 2 by Rh substitution

The compound SrNi 2⁢ P 2 is unique among the ThCr 2 ⁢Si 2 class since it exhibits a temperature-induced transition upon cooling from an uncollapsed tetragonal (ucT) state to a one-third-collapsed orthorhombic (tcO) state where one out of every three P-rows bond across the Sr layers. This compound is also known for exhibiting bulk superconductivity below 1.4 K at ambient pressure. Here, in this paper, we report on the effects of Rh substitution in Sr⁢(Ni 1-x ⁢Rh x ) 2 ⁢P 2 on the structural and superconducting properties. We studied the variation of the nearest P-P distances as a function of the Rh fraction at room temperature, as well as its temperature dependence for selected compositions. We find that increasing the Rh fraction leads to a decrease in the transition temperature between the ucT and tcO states, until a full suppression of the tcO state for x ≥ 0.166. The superconducting transition first remains nearly insensitive to the Rh fraction, and then it increases to 2.3 K after the tcO state is fully suppressed. These results are summarized in a phase diagram, built upon the characterization by energy dispersive x-ray spectroscopy, x-ray diffraction, resistance, magnetization, and specific heat measurements done on crystalline samples with varying Rh content. The relationship between band structure, crystal structure, and superconductivity is discussed based on previously reported band structure calculations on SrRh 2 ⁢P 2 . Moreover, the effect of Rh fraction on the stress-induced structural transitions is also addressed by means of strain-stress studies done by uniaxial compression of single-crystalline micropillars of Sr⁢(Ni 1-x ⁢Rh x ) 2 ⁢P 2 .

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Saturn's rings - Properties and processes

In the present consideration of the structural and particle properties of Saturn's rings, emphasis is given to spacecraft observations and an attempt is made to relate observed properties to favored causative processes. While the ring particles are primarily icy, there is evidence for compositional variation on both local and regional scales. Ring structure is generally dominated by collisional and gravitational dynamics. On the basis of such features as orbital resonances with various satellites, which drive spiral density and bending waves, the ring mass density and local vertical thickness can be determined.

Cuzzi, J. N.↗

Interpretation of coronal synoptic observations

Three-dimensional reconstruction techniques used to determine coronal density distributions from synoptic data are complicated and time consuming to employ. Current techniques also assume time invariant structures and thus mix both temporal and spatial variations present in the coronal data. The observed distribution of polarized brightness, pB, and brightness, B, of coronal features observed either at eclipses or with coronagraphs depends upon both the three-dimensional distribution of electron density within the structure and the location of the feature with respect to the plane-of-the-sky. By theoretically studying the signature of various coronal structures as they would appear during a limb transit, it is possible to recognize these patterns in real synoptic data as well as estimate temporal evolutionary effects.

Munro, R. H.↗

Effects of thermophoresis on high-pressure binary-species boundary layers with uniform and non-uniform compositions

Direct numerical simulations of high-pressure binary-species temporal boundary layers are performed to investigate the flow physics for three situations: (1) uniform and equal composition, (2) uniform but unequal compositions and (3) non-uniform composition. Both colder- and hotter-wall situations compared with the free stream are simulated. The working fluid is a nitrogen/methane mixture. The analysis is performed at a case-specific self-similar state. Even when the initial composition is uniform, the methane mean mass fraction decreases near the colder wall, whereas it increases near the hotter wall and the mass fraction fluctuates in the entire boundary layer. Analysis of the species-mass diffusion balance and flow structures reveal that both mass-fraction variation and fluctuations are induced by the Soret effect. When the initial composition is non-uniform and the wall is colder, the methane mean mass fraction monotonically increases from the wall akin to its initial profile. However, when the wall is hotter the mean mass fraction decreases near the wall in contrast to its initial profile, a fact traced through the species-mass diffusion balance to the Soret effect being large and enriching methane near the wall. In contrast, the direction of the Soret flux is opposite for the colder wall, thus keeping the methane concentration small. Although the initial magnitude of the difference between the wall and free-stream temperature is the same in all cases, the situation is not symmetric between colder- and hotter-wall cases; the flow structure exhibits much smaller scales when the wall is hotter than when the wall is colder.

Mechanics↗

Lattice Relaxations in Bixbyite‐Structured Rare‐Earth Sesquioxides

This report examines atomic relaxations in rare‐earth sesquioxides with the cubic bixbyite crystal structure. In particular, the experimentally determined unit cell atom positions in bixbyite compounds are compared to “ideal” bixbyite atom positions, where the concept of ideality is based on similarities between the bixbyite and fluorite crystal structures. Analyses indicate that all rare‐earth sesquioxide compounds deviate from ideality in similar ways and that there is a trend wherein the magnitudes of these atomic deviations decrease with increasing cationic size. The deviations from an ideal, fluorite‐like structure produce highly distorted coordination polyhedra and variations in metal‐oxygen bond lengths. A modified bond valence sum analysis revealed that the first nearest neighbor cation‐anion bond length variations lead to large (20%) variations in cation‐anion bond strength. This report also provides a qualitative analysis regarding the accuracy of atomic relaxed deviation parameters, based on x‐ray diffraction measurements. The analysis indicates that uncertainties in the accuracy of measured oxygen relaxed deviation parameters in bixbyite sesquioxides are likely much greater than the published uncertainties.

36 MATERIALS SCIENCE↗

Temperature induced distortions in space telescope mirrors

In this paper, it is illustrated how measured instantaneous coefficients of thermal expansion (CTE) can be accurately taken into account when modeling the structural behavior of space based optical systems. In particular, the importance of including CTE spatial variations in the analysis of optical elements is emphasized. A comparison is made between the CTE's of three optical materials commonly used in the construction of space mirrors (ULE, Zerodur, and beryllium). The overall impact that selection of any one of these materials has on thermal distortions is briefly discussed. As an example of how temperature dependent spatial variations in thermal strain can be accurately incorporated in the thermo-structural analysis of a precision optical system, a finite element model is developed, which is used to estimate the thermally induced distortions in the Hubble Space Telescope's (HST) primary mirror. In addition to the structural analysis, the optical aberrations due to thermally induced distortions are also examined. These calculations indicate that thermal distortions in HST's primary mirror contribute mainly to defocus error with a relatively small contribution to spherical aberration.

Nied, H. F.↗

Damage Tolerance Behavior of Friction Stir Welds in Aluminum Alloys

Friction stir welding is a solid state welding process used in the fabrication of various aerospace structures. Self-reacting and conventional friction stir welding are variations of the friction stir weld process employed in the fabrication of cryogenic propellant tanks which are classified as pressurized structure in many spaceflight vehicle architectures. In order to address damage tolerance behavior associated with friction stir welds in these safety critical structures, nondestructive inspection and proof testing may be required to screen hardware for mission critical defects. The efficacy of the nondestructive evaluation or the proof test is based on an assessment of the critical flaw size. Test data describing fracture behavior, residual strength capability, and cyclic mission life capability of friction stir welds at ambient and cryogenic temperatures have been generated and will be presented in this paper. Fracture behavior will include fracture toughness and tearing (R-curve) response of the friction stir welds. Residual strength behavior will include an evaluation of the effects of lack of penetration on conventional friction stir welds, the effects of internal defects (wormholes) on self-reacting friction stir welds, and an evaluation of the effects of fatigue cycled surface cracks on both conventional and selfreacting welds. Cyclic mission life capability will demonstrate the effects of surface crack defects on service load cycle capability. The fracture data will be used to evaluate nondestructive inspection and proof test requirements for the welds.

McGill, Preston↗

Design of Superconducting Gravity Gradiometer Cryogenic System for Mars Mission

Measurement of a planets gravity field provides fundamental information about the planets mass properties. The static gravity field reveals information about the internal structure of the planet, including crustal density variations that provide information on the planets geological history and evolution. The time variations of gravity result from the movement of mass inside the planet, on the surface, and in the atmosphere. NASA is interested in a Superconducting Gravity Gradiometer (SGG) with which to measure the gravity field of a planet from orbit. An SGG instrument is under development with the NASA PICASSO program, which will be able to resolve the Mars static gravity field to degree 200 in spherical harmonics, and the time-varying field on a monthly basis to degree 20 from a 255 x 320 km orbit. The SGG has a precision two orders of magnitude better than the electrostatic gravity gradiometer that was used on the ESAs GOCE mission. The SGG operates at the superconducting temperature lower than 6 K. This study developed a cryogenic thermal system to maintain the SGG at the design temperature in Mars orbit. The system includes fixed radiation shields, a low thermal conductivity support structure and a two-stage cryocooler. The fixed radiation shields use double aluminized polyimide to emit heat from the warm spacecraft into the deep space. The support structure uses carbon fiber reinforced plastic, which has low thermal conductivity at cryogenic temperature and very high stress. The low vibration cryocooler has two stages, of which the high temperature stage operates at 65 K and the low temperature stage works at 6 K, and the heat rejection radiator works at 300 K. The study also designed a second option with a 4-K adiabatic demagnetization refrigerator (ADR) and two-stage 10-K turbo-Brayton cooler.

Li, X.↗

Design of Superconducting Gravity Gradiometer Cryogenic System for Mars Mission

Measurement of a planet's gravity field provides fundamental information about the planet's mass properties. The static gravity field reveals information about the internal structure of the planet, including crustal density variations that provide information on the planet's geological history and evolution. The time variations of gravity result from the movement of mass inside the planet, on the surface, and in the atmosphere. NASA is interested in a Superconducting Gravity Gradiometer (SGG) with which to measure the gravity field of a planet from orbit. An SGG instrument is under development with the NASA PICASSO program, which will be able to resolve the Mars static gravity field to degree 200 in spherical harmonics, and the time-varying field on a monthly basis to degree 20 from a 255 x 320 km orbit. The SGG has a precision two orders of magnitude better than the electrostatic gravity gradiometer that was used on the ESA's GOCE mission. The SGG operates at the superconducting temperature lower than 6 K. This study developed a cryogenic thermal system to maintain the SGG at the design temperature in Mars orbit. The system includes fixed radiation shields, a low thermal conductivity support structure and a two-stage cryocooler. The fixed radiation shields use double aluminized polyimide to emit heat from the warm spacecraft into the deep space. The support structure uses carbon fiber reinforced plastic, which has low thermal conductivity at cryogenic temperature and very high stress. The low vibration cryocooler has two stages, of which the high temperature stage operates at 65 K and the low temperature stage works at 6 K, and the heat rejection radiator works at 300 K. The study also designed a second option with a 4-K adiabatic demagnetization refrigerator (ADR) and two-stage 10-K turbo-Brayton cooler.

Gradiometer↗

Definitive Assessment of the Accuracy, Variationality, and Convergence of Relativistic Coupled Cluster and Density Matrix Renormalization Group in 100-Orbital Space

Accuracy, variationality, and convergence underpin the reliability of modern electronic structure methods, yet definitive benchmarks in the relativistic regime remain elusive due to the absence of numerically exact full configuration interaction (CI) references. Recent algorithmic advances in the CI framework, enabled by the small-tensor-product (STP) decomposition approach, have dramatically extended the tractable size of the configuration space, making numerically exact CI calculations feasible in large active spaces previously beyond reach. In this paper, we employ the recently developed STP-CI framework to perform large-scale numerically exact CI calculations and directly benchmark relativistic coupled cluster and density matrix renormalization group methods. Definitive benchmarking of approximate relativistic electronic structure methods is ensured through the application of the gap theorem, which provides rigorous error bounds on the CI reference and establishes a controlled standard for assessing accuracy, variationality, and convergence.

Chemical calculations↗

Molecular-dynamics simulation methods for macromolecular crystallography

It is investigated whether molecular-dynamics (MD) simulations can be used to enhance macromolecular crystallography (MX) studies. Historically, protein crystal structures have been described using a single set of atomic coordinates. Because conformational variation is important for protein function, researchers now often build models that contain multiple structures. Methods for building such models can fail, however, in regions where the crystallographic density is difficult to interpret, for example at the protein–solvent interface. To address this limitation, a set of MD–MX methods that combine MD simulations of protein crystals with conventional modeling and refinement tools have been developed. In an application to a cyclic adenosine monophosphate-dependent protein kinase at room temperature, the procedure improved the interpretation of ambiguous density, yielding an alternative water model and a revised protein model including multiple conformations. The revised model provides mechanistic insights into the catalytic and regulatory interactions of the enzyme. The same methods may be used in other MX studies to seek mechanistic insights.

59 BASIC BIOLOGICAL SCIENCES↗

Constraining level densities through quantitative correlations with cross-section data

The adopted level densities (LD) for the nuclei produced through different reaction mechanisms significantly impact the accurate calculation of cross sections for the different reaction channels. Many common LD models make simplified assumptions regarding the overall behavior of the total LD and the intrinsic spin and parity distributions of the excited states. However, very few experimental constraints are taken into account in these models: LD at neutron separation energy coming from average spacings of s- and p-wave resonances ( D 0 and D 1 , respectively) whenever they have been previously measured, and the sometimes subjective extrapolation of discrete levels. These, however, constrain the LD only in very specific regions of excitation energy, and for specific spins and parities. This work aims to establish additional experimental constraints on LD through quantitative correlations between cross sections and LD. This allows for fitting and the determination of detailed structures in LD. For this we use the microscopic Hartree-Fock-Bogoliubov (HFB) LD as a starting point as the HFB LD provide a more realistic spin and parity distributions than phenomenological models such as Gilbert-Cameron (GC). We then associate variations predicted by the HFB model with the structure observed in double-differential cross sections at low outgoing neutron energy, a region that is dominated by the LD input. We also use (n, p) on 56 Fe , as an example case where angle-integrated cross sections are extremely sensitive to LD. For comparison purposes we also perform calculations with the GC model. With this approach we are able to perform fits of the LD based on actual experimental data, constraining the model and ensuring its consistency. This approach can be particularly useful in extrapolating the LD to nuclei for which high-excited discrete levels and/or values of D 0 or D 1 are unknown. Finally, it also predicts neutron-induced inelastic γ cross sections that in some cases can differ significantly from more standard phenomenological LD models such as GC.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

The influence of cooling rates on strain phase diagrams and domain structures of ferroelectric thin films: A case study of PbTiO 3

Strain engineering has been established as an effective approach to control phase equilibria, domain configurations, and functional properties of ferroelectric thin films. Temperature-strain phase diagrams have been used as powerful tools for providing insights into strain engineering. However, almost all existing phase diagrams established using the phase-field approach assume quenching conditions without considering actual cooling rates during the post-deposition annealing process of ferroelectric thin films. Within this work, we systematically investigate the influence of cooling rates on domain structures and the strain-phase diagram of ferroelectric thin films using phase-field simulations, taking PbTiO 3 thin films as a model system. We found that both the position of phase boundaries in the strain phase diagrams and the domain morphology are significantly influenced by the cooling rates. It is revealed that while the paraelectric-ferroelectric phase boundary remains invariant, the phase boundaries between single-phase and multi-phase regions tend to shift toward the corresponding multi-phase region as the cool rate reduces. Slow cooling generally leads to more ordered domain structures with increased domain size. Using the obtained equilibrium domain structures, we calculated effective thermal conductivities and found significant variations that can be tuned by the cooling rates. In conclusion, this work reveals an underexplored yet critical impact of cooling rates on phase equilibria and domain structures in ferroelectric thin films, which may inspire further fine-tuning of domains and domain walls in low-dimensional ferroelectrics for multifunctional applications.

Domain structures↗

Simulation of a PCM Integrated Heat Pump Using Time-of-Use Utility Structure based Control Strategy for Demand Response

To mitigate the variation in demand on the electric grid, thermal energy storage (TES) is an alternative to electric batteries and constructing new peaking power plants. The aggressive carbon reduction goals of the United States are accelerating the electrification of building equipment. If space heating and cooling in the US were electrified using conventional heat pump technologies, the winter electric grid peak would approximately double. Integrating TES with heat pump (HP) enables electrification of space cooling and heating devices without overtaxing the grid.This paper evaluates the benefits of a novel phase change material (PCM) integrated heat pump configuration via simulation. A one-dimensional PCM heat exchanger model which discretizes the PCM tank and refrigerant tubes into small control volumes is developed. Each control volume can have different PCM temperatures, PCM properties, and heat transfer coefficients. The PCM tank is charged by a wrapped tank condenser and discharged by an internal refrigerant coil. The PCM heat exchanger model is integrated into DOE/ORNL Heat Pump Design Model for heat pump system simulation.To demonstrate the performance of the PCM integrated heat pump, a case study in Chicago was performed. A Time-of-Use utility structure-based control strategy is implemented to schedule the PCM tank charging and discharging mode switching. Compared with a conventional electric heat pump, the PCM integrated heat pump shows superior performance on load shifting and utility cost reduction. As a result, the proposed system demonstrates 24.6% utility saving for cooling application and 25.8% utility saving for heating application.

Li, Zhenning↗