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At least 379 records · Page 21

Numerical simulation of a sudden stratospheric warming with a three-dimensional, spectral, quasi-geostrophic model

An analysis of a sudden stratospheric warming which developed spontaneously during a winter simulation with a three-dimensional quasi-geostrophic model is described. Changes in the circulation and thermal structure of the winter polar stratosphere that occurred during the warming are shown to be in close agreement with observed behavior: enhanced vertical flux of eddy energy into the stratosphere, rapid temperature increase in high latitudes with a reversal of the zonal mean temperature gradient between midlatitude and pole, destruction of the circumpolar cyclonic vortex, and a marked deceleration of the westerly jet and the appearance of zonal mean easterlies. Energies of the warming are also consistent with observed characteristics. Many aspects of the dynamical development of the present model simulation are shown to agree with a previous model simulation, but there are also areas of disagreement.

Grose, W. L.↗

Structural features of conducting quasi-one-dimensional organic halides and pseudohalides

The physical properties of quasi-one-dimensional conductors are profoundly influenced by slight changes in structure. The unusual structural features of this class of materials include only short range order of the anions and structure modulation. The nature of disorder and structure modulation can affect the character of the metal-to-insulator transition at low temperature, and may allow us to make some predictions of low temperature behavior based on room temperature structural properties.

Williams, R.↗

A two-dimensional photochemical model of the atmosphere. I Chlorocarbon emissions and their effect on stratospheric ozone

A two-dimensional photochemical model is used to examine changes to the ozone layer caused by emissions of CFCl3, CF2Cl2, CH3CCl3 and CCl4. The influence of a possible secular increase in tropospheric methane up to 2 percent per year was found to be small, although it acts to mask decreases in total ozone caused by the chlorocarbons. Increasing NO(x) emissions caused by industralization also tend to mask decreases in total ozone and may have caused total ozone to increase by about 1 percent. The model-calculated ozone decreases are estimated to be about 3 percent by 1980. This estimate is higher than estimates by similar models, although it is noted that CCl4 and CH3CCl3 emissions are included in the model in addition to CFCl3 and CF2Cl2. This is significant because the model indicates that CCl4 has dominated the ozone depletions so far, and knowledge of the historical emission rate of CCl4 to the atmosphere is incomplete. There remain sufficient significant disagreements between theoretical and observed concentrations and variabilities, particularly for odd nitrogen and ClO, to caution against assigning too much confidence in the calculated ozone depletion.

Gidel, L. T.↗

A simulation analysis of the fate of phytoplankton within the mid-Atlantic bight

A time-dependent, three-dimensional simulation model of wind-induced changes of the circulation field, of light and nutrient regulation of photosynthesis, of vertical mixing as well as algal sinking, and of herbivore grazing stress, is used to analyze the seasonal production, consumption, and transport of the spring bloom within the mid-Atlantic Bight. The particular case (c) of a 58-day period in February-April 1979, simulated primary production, based on both nitrate and recycled nitrogen, with a mean of 0.62 g C sq m/day over the whole model domain, and an export at the shelf-break off Long Island of 2.60 g ch1 sq m/day within the lower third of the water column. About 57% of the carbon fixation was removed by herbivores, with 21% lost as export, either downshelf or offshore to slope waters, after the first 58 days of the spring bloom. Extension of the model for another 22 days of case (c) increased the mean export to 27%, while variation of the model's parameters in 8 other cases led to a range in export from 8% to 38% of the average primary production. Spatial and temporal variations of the simulated albal biomass, left behind in the shelf water column, reproduced chlorophyll fields sensed by satellite, shipboard, and in situ instruments.

Walsh, J. J.↗

The structure and dynamics of reacting plane mixing layers

Experimental studies of the combusting mixing layers formed over a rearward facing step and between two parallel streams are reported. The steady behavior of the mean properties of the reacting flows is similar to that of nonreacting flows except for the global effects of thermodynamic property changes. Vortices form by the two-dimensional K-H instability and grow by subharmonic combination until the layer begins to interact with the walls. Unsteady behavior occurs when there are resonator interactions with the K-H instability or the instability associated with the recirculation vortex in the rearward facing step flow.

Keller, J. O.↗

Program Manipulates Plots For Effective Display

Windowed Observation of Relative Motion (WORM) computer program primarily intended for generation of simple X-Y plots from data created by other programs. Enables user to label, zoom, and change scales of various plots. Three-dimensional contour and line plots provided. Written in PASCAL.

Bauer, F.↗

Global environmental effects of impact-generated aerosols: Results from a general circulation model

Interception of sunlight by the high altitude worldwide dust cloud generated by impact of a large asteroid or comet would lead to substantial land surface cooling, according to the three-dimensional atmospheric general circulation model (GCM). This result is qualitatively similar to conclusions drawn from an earlier study that employed a one-dimensional atmospheric model, but in the GCM simulation the heat capacity of the oceans, not included in the one-dimensional model, substantially mitigates land surface cooling. On the other hand, the low heat capacity of the GCM's land surface allows temperatures to drop more rapidly in the initial stages of cooling than in the one-dimensional model study. GCM-simulated climatic changes in the scenario of asteroid/comet winter are more severe than in nuclear winter because the assumed aerosol amount is large enough to intercept all sunlight falling on earth. Impacts of smaller objects could also lead to dramatic, though of course less severe, climatic changes, according to the GCM. An asteroid or comet impact would not lead to anything approaching complete global freezing, but quite reasonable to assume that impacts would dramatically alter the climate in at least a patchy sense.

Covey, Curt↗

A numerical simulation of climate changes during the obliquity cycle on Mars

A one-dimensional seasonal energy balance climate model of the Martian surface is developed. The model shows the importance of using short-period diurnal and seasonal variations of solar irradiance instead of yearly-averaged quantities. The roles of meridional heat transport and greenhouse warming are shown to be important. The possible existence of hysteresis cycles in the formation and sublimation of permanent deposits during the course of the obliquity cycle is demonstrated.

Francois, L. M.↗

Sliding Contact Bearings for Service to 700 C

Cylindrical, sliding contact bearings made entirely of a self-lubricating powder metallurgy composite (PM212) or of super alloy shells lined with clad PM212 were tested in an oscillating mode at temperatures from 25 to 700 C. Tests of 100 hr duration or longer were conducted at a bearing unit load of 3.45 Mpa (500 psi). Shorter duration tests at various unit loads up to 24.1 Mpa (3500 psi) were also conducted. In comparison tests, bearings lubricated with PM212 had superior anti-wear characteristics compared to the baseline, unlubricated, super alloy bearings: no galling of PM212-lubricated bearings occurred, while severe surface damage including galling occurred, especially at high loads, during the baseline tests. A heat treatment procedure, which dimensionally stabilizes PM212 and thereby minimizes clearance changes during high temperature bearing operation, is described.

Sliney, Harold E.↗

The Prediction of Scattered Broadband Shock-Associated Noise

A mathematical model is developed for the prediction of scattered broadband shock-associated noise. Model arguments are dependent on the vector Green's function of the linearized Euler equations, steady Reynolds-averaged Navier-Stokes solutions, and the two-point cross-correlation of the equivalent source. The equivalent source is dependent on steady Reynolds-averaged Navier-Stokes solutions of the jet flow, that capture the nozzle geometry and airframe surface. Contours of the time-averaged streamwise velocity component and turbulent kinetic energy are examined with varying airframe position relative to the nozzle exit. Propagation effects are incorporated by approximating the vector Green's function of the linearized Euler equations. This approximation involves the use of ray theory and an assumption that broadband shock-associated noise is relatively unaffected by the refraction of the jet shear layer. A non-dimensional parameter is proposed that quantifies the changes of the broadband shock-associated noise source with varying jet operating condition and airframe position. Scattered broadband shock-associated noise possesses a second set of broadband lobes that are due to the effect of scattering. Presented predictions demonstrate relatively good agreement compared to a wide variety of measurements.

Miller, Steven A. E.↗

Calculation of the Heat Transfer Coefficient in the Outer Body for a Rotational Detonation

Unsteady heat transfer characterization on the combustion surfaces of Rotational Detonation Engines (RDE) is not well understood. It is generally thought that the complex nature of the unsteady, reacting, compressible fluid flow inside the combustion anulus of the RDE causes the convective heat transfer coefficient to be significantly higher than it is in other applications. Empirical models that have been used to analyze this strictly apply to steady flows where dimensionless groups can be employed. The reacting flow fields that are characteristic of RDEs are inherently compressible, three dimensional, unsteady, and turbulent, having properties that change by orders of magnitude throughout the flow field. They will therefore contain multiple length scales and time scales operating everywhere in the flow during all times. Because of this it is not likely that the RDE flow fields will lend themselves to explanation using simple dimensionless parameters. The dimensionless groups have meaning only in situations where length scales and time scales are singular and well defined. In spite of this it may be possible to get a relatively good idea of what the convection heat transfer coefficient is. In this work a numerical study is performed where the inside wall surface temperature distribution in the RDE outer body is systematically changed over a given range that would be characteristic of the start-up flows inside an RDE. For each case, temperature distributions inside the outer containment wall of the RDE was calculated and compared with experimental data. The closet match can then be used to directly calculate the convection heat transfer coefficient on the inside surface of the RDE.

VanOsdol, John↗

Constraining Flexibility in the MIL-88 Topology through Integration of 3-Dimensional Linkers

Metal–organic frameworks (MOFs) are a class of crystalline, nanoporous materials that are recognized for their tunability. While some MOFs demonstrate flexibility, this characteristic can pose challenges in achieving precise pore control or establishing permanent porosity. Specifically, MIL-88B, is notable for its high flexibility, as it is constructed from metal trimer clusters and 2-dimensional linkers (2DLs) featuring planar, aromatic cores, allowing significant structural changes. In this study, we synthesized two new MOFs, NU-2010 and NU-2011, which are structurally analogous to MIL-88B but incorporate ditopic 3-dimensional linkers (3DLs) with sterically bulky cores and higher symmetry. Our aim was to investigate whether the introduction of 3DLs could mitigate the flexibility observed in MIL-88B. We employed a combination of single crystal and powder X-ray diffraction techniques to assess the flexibility of MIL-88B, NU-2010, and NU-2011 under various conditions including thermal activation, solvent exchange, and temperature changes. Furthermore, our findings indicate that incorporating 3DLs significantly reduces framework flexibility in NU-2010 and NU-2011 relative to MIL-88B.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Biosignature Anisotropy Modeled on Temperate Tidally Locked M-Dwarf Planets

A planet’s atmospheric constituents (e.g., O2, O3, H2Ov, CO2, CH4, and N2O) can provide clues to its surface habitability, and may offer biosignature targets for remote life detection efforts. The plethora of rocky exoplanets found by recent transit surveys (e.g., the Kepler mission) indicates that potentially habitable systems orbiting K- and M-dwarf stars may have very different orbital and atmospheric characteristics than Earth. To assess the physical distribution and observational prospects of various biosignatures and habitability indicators, it is important to understand how they may change under different astrophysical and geophysical configurations, and to simulate these changes with models that include feedbacks between different subsystems of a planet’s climate. Here we use a three-dimensional (3D) Chemistry–Climate model (CCM) to study the effects of changes in stellar spectral energy distribution (SED), stellar activity, and planetary rotation on Earth analogs and tidally locked planets. Our simulations show that, apart from shifts in stellar SEDs and UV radiation, changes in illumination geometry and rotation-induced circulation can influence the global distribution of atmospheric biosignatures. We find that the stratospheric day-to-nightside mixing ratio differences on tidally locked planets remain low (<20%) across the majority of the canonical biosignatures. Interestingly, however, secondary photosynthetic biosignatures (e.g., C2H6S) show much greater (∼67%) day-to-nightside differences, and point to regimes in which tidal locking could have observationally distinguishable effects on phase curve, transit, and secondary eclipse measurements. Overall, this work highlights the potential and promise for 3D CCMs to study the atmospheric properties and habitability of terrestrial worlds.

Chen, Howard↗

Differentiating Three-Dimensional Molecular Structures Using Laser-Induced Coulomb Explosion Imaging

Coulomb explosion imaging (CEI) with x-ray free electron lasers has recently been shown to be a powerful method for obtaining detailed structural information of gas-phase planar ring molecules [R. Boll et al., X-ray multiphoton-induced Coulomb explosion images complex single molecules, Nat. Phys. 18, 423 (2022).]. In this Letter, we investigate the potential of CEI driven by a tabletop laser and extend this approach to differentiating three-dimensional structures. We study the static CEI patterns of planar and nonplanar organic molecules that resemble the structures of typical products formed in ring-opening reactions. Here, our results reveal that each molecule exhibits a well-localized and distinctive pattern in three-dimensional fragment-ion momentum space. We find that these patterns yield direct information about the molecular structures and can be qualitatively reproduced using a classical Coulomb explosion simulation. Our findings suggest that laser-induced CEI can serve as a robust method for differentiating molecular structures of organic ring and chain molecules. As such, it holds great promise as a method for following ultrafast structural changes, e.g., during ring-opening reactions, by tracking the motion of individual atoms in pump-probe experiments.

74 ATOMIC AND MOLECULAR PHYSICS↗

Monitoring changes in upper ocean heat storage from satellites

A one-dimensional model of the upper ocean mixed-layer was developed to determine how the parameters which can be measured from satellites affect the development of the layer. The results show that the form of the dissipation term is important in achieving cyclic annual states, that the layer deepending rate depends on the averaging period for the surface heat flux and wind stress, that wind direction, as well as magnitude, can affect the deepening rate and that horizontal advective effects cannot simply be superimposed on the model results. An algorithm is given which uses satellite derived wind stress and sea surface temperature data to predict real time changes in upper ocean heat storage during the cooling seasons.

Miller, J. R.↗

Initial values for the integration scheme to compute the eigenvalues for propagation in ducts

A scheme for the calculation of eigenvalues in the problem of acoustic propagation in a two-dimensional duct is described. The computation method involves changing the coupled transcendental nonlinear algebraic equations into an initial value problem involving a nonlinear ordinary differential equation. The simplest approach is to use as initial values the hardwall eigenvalues and to integrate away from these values as the admittance varies from zero to its actual value with a linear variation. The approach leads to a powerful root finding routine capable of computing the transverse and axial wave numbers for two-dimensional ducts for any frequency, lining, admittance and Mach number without requiring initial guesses or starting points.

Eversman, W.↗

Spectroscopic Signatures of Phonon Character in Molecular Electron Spin Relaxation

Spin–lattice relaxation constitutes a key challenge for the development of quantum technologies, as it destroys superpositions in molecular quantum bits (qubits) and magnetic memory in single molecule magnets (SMMs). Gaining mechanistic insight into the spin relaxation process has proven challenging owing to a lack of spectroscopic observables and contradictions among theoretical models. Here, we use pulse electron paramagnetic resonance (EPR) to profile changes in spin relaxation rates (T 1 ) as a function of both temperature and magnetic field orientation, forming a two-dimensional data matrix. For randomly oriented powder samples, spin relaxation anisotropy changes dramatically with temperature, delineating multiple regimes of relaxation processes for each Cu(II) molecule studied. We show that traditional T 1 fitting approaches cannot reliably extract this information. Single-crystal T 1 anisotropy experiments reveal a surprising change in spin relaxation symmetry between these two regimes. We interpret this switch through the concept of a spin relaxation tensor, enabling discrimination between delocalized lattice phonons and localized molecular vibrations in the two relaxation regimes. Variable-temperature T 1 anisotropy thus provides a unique spectroscopic method to interrogate the character of nuclear motions causing spin relaxation and the loss of quantum information.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗