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At least 145 records · Page 8

Integral cross sections for the direct excitation of the A 3 (sigma) u +, B 3 (pi) g, W 3 (delta) u, B' 3 (sigma) u -, a' 1 (sigma) u -, a 1 (pi) g, w 1 (delta) u, and C 3 (pi) u electronic states in

Integral cross sections for electron impact excitation out of the ground state (X 1(sigma)g +) to the A 3(sigma)u +, B 3(pi)g, W 3(delta)u, B' 3(sigma)u -, a' 1(sigma)u -, a 1(pi)g, w 1(delta)u, and states in N2 are reported at incident energies ranging between 10 and 100 eV. These data have been derived by integrating differential cross sections previously reported by this group. New differential cross section measurements for the a 1(pi)g state at 200 eV are also presented to extend the range of the reported integral cross sections for this state, which is responsible for the emissions of the Lyman-Birge-Hopfield band system (a 1(pi)g (rightwards arrow) X 1(sigma)g +). The present results are compared and critically evaluated against existing cross sec In general, the present cross sections are smaller than previous results at low impact energies from threshold through the excitation function peak regions. These lower cross sections have potentially significant implications on our understanding of UV emissions in the atmospheres of Earth and Titan.

Ultraviolet Imaging Spectograph↗

Enhancement of a global lake and reservoir database to aid climate studies and resource monitoring utilizing satellite radar altimetry

Here, we describe the expansion and enhancement of a large (surface area ≥100 sq. km) lake and reservoir database (1.GREALD). These efforts have also resulted in the spin-off of two additional databases, one containing lakes and reservoirs (2.GREALD, area 10–99 sq. km), and the other containing ephemeral lakes (3.GELD, area ≥100 sq. km). These databases are unique sources for projects that utilize satellite radar altimeter data to monitor surface water levels. While 1.GREALD aims to be a complete catalog, 2.GREALD focuses on reservoirs in response to applied sciences programs that monitor water and energy resources. The creation of 3.GELD has climate change objectives as well as water resources and ecosystem conservation applications. The recording of information pertaining to the potential overpasses (waterbody crossings) of the current and archive satellite altimeters is a primary objective as is the need to highlight any form of controlled water level variation. The permanent water databases now contain 6282 entries, half experience some form of anthropogenic influence and ∼430 have been identified as potential climatically sensitive terminal lakes. The revised integral surface area distribution is a power law with exponent −1.016. Statistics reveal that with altimetric repeat visit times of 10-day to monthly, at least 80% of the permanent water bodies (≥10 sq. km) have been overflown at some period since the 1990s. Current information on water use and reservoir formation date show that the primary use of the reservoir class is hydroelectric power, and that China, Brazil, India, Turkey, and Vietnam dominate the dam building in recent decades.

Charon M. Birkett↗

Validity of approximate methods in molecular scattering. III - Effective potential and coupled states approximations for differential and gas kinetic cross sections

Two dimensionality-reducing approximations, the j sub z-conserving coupled states (sometimes called the centrifugal decoupling) method and the effective potential method, were applied to collision calculations of He with CO and with HCl. The coupled states method was found to be sensitive to the interpretation of the centrifugal angular momentum quantum number in the body-fixed frame, but the choice leading to the original McGuire-Kouri expression for the scattering amplitude - and to the simplest formulas - proved to be quite successful in reproducing differential and gas kinetic cross sections. The computationally cheaper effective potential method was much less accurate.

Monchick, L.↗

Recent advances in the quantification of uncertainties in reaction theory

Uncertainty quantification has become increasingly more prominent in nuclear physics over the past several years. In few-body reaction theory, there are four main sources that contribute to the uncertainties in the calculated observables: the effective potentials, approximations made to the few-body problem, structure functions, and degrees of freedom left out of the model space. In this work, we illustrate some of the features that can be obtained when modern statistical tools are applied in the context of nuclear reactions. This work consists of a summary of the progress that has been made in quantifying theoretical uncertainties in this domain, focusing primarily on those uncertainties coming from the effective optical potential as well as their propagation within various reaction theories. We use, as the central example, reactions on the doubly-magic stable nucleus 40 Ca, namely neutron and proton elastic scattering and single-nucleon transfer 40 Ca(d,p) 41 Ca. First, we show different optimization schemes used to constrain the optical potential from differential cross sections and other experimental constraints; we then discuss how these uncertainties propagate to the transfer cross section, comparing two reaction theories. Finally, we finish by laying out our future plans.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Comment on the relation between the nonadiabatic coupling and the complex intersection of potential energy curves

Simple relations are discussed that provide a correspondence between the complex intersection of two potential surfaces and the nonadiabatic coupling matrix element between those surfaces. These are key quantities in semiclassical and quantum mechanical theories of collision induced electronic transitions. Within the two state approximation, the complex intersection is shown to be directly related to the location and magnitude of the peak in the nonadiabatic coupling. Two cases are considered: the avoided crossing between two potential surfaces; and the spin orbit interaction due to a P-2 halogen atom. Comparisons are made between the results of the two-state model and the results of ab initio quantum chemical calculations.

Jaffe, R. L.↗

Comment on the relation between the nonadiabatic coupling and the complex intersection of potential energy curves

Simple relations are discussed that provide a correspondence between the complex intersection of two potential surfaces and the nonadiabatic coupling matrix element between those surfaces. These are key quantities in semiclassical and quantum-mechanical theories of collision-induced electronic transitions. Within the two-state approximation, the complex intersection is shown to be directly related to the location and magnitude of the peak in the nonadiabatic coupling. Two cases have been considered: (1) the avoided crossing between two potential surfaces, and (2) the spin-orbit interaction due to a 2P halogen atom. Comparisons are made between the results of the two-state model and the results of ab initio quantum chemical calculations.

Jaffe, R. L.↗

Regional Geology Capstone Report for the Midwestern Regional Carbon Sequestration Partnership (Volume V)

The Midwest Regional Carbon Sequestration Partnership (MRCSP) was founded in 2003 as part of the U.S. Department of Energy’s (DOE’s) Regional Carbon Sequestration Partnership initiative. Since its founding, MRCSP has made significant strides toward making CCUS a viable option for states in the region. The public/private consortium, funded through the DOE Regional Carbon Sequestration Initiative, brings together nearly 40 industry partners and 10 states. Battelle, as the project lead, oversees research, development and operations and coordinates activities among the partners. The incremental, phased approach has built a valuable knowledge base for the industry and paved the way for commercial-scale adoption of CCUS technologies. From 2008 to 2020, MRCSP Phase III focused on the development of large-scale injection projects. This report is part of a series of reports prepared under the Midwestern Regional Carbon Sequestration Partnership (MRCSP) Phase III (Development Phase). These reports summarize and detail the findings of the work conducted under the Phase III project. The MRCSP regional geology Capstone report summarizes the regional characterization of geologic storage subtasks performed under MRCSP Phase III. The regional characterization work was completed by the state geological surveys of Delaware, Indiana, Kentucky, Maryland, New York, Ohio, Pennsylvania, and West Virginia along with Western Michigan University and Rutgers University. Building on the Phases I and II, the Phase III research was focused on key research topics identified in previous MRCSP efforts: [1] Regional Geologic Cross Sections for Potential Storage and Containment Zones; [2] Appalachian Basin: Enhanced Recovery Opportunities; [3] Michigan Basin: Assessment of Enhanced Oil Recovery Using Carbon Dioxide in Silurian Pinnacle Reefs; [4] Mid-Atlantic Coastal Plain and Adjacent Offshore Region: Characterization of Carbon Storage Targets; [5] Ordovician-Cambrian Units: Hierarchical Evaluation of Geologic Carbon Storage Resource Estimates; [6] Upper Silurian to Middle Devonian Strata of Ohio: Structural Characterization of Potential CO 2 Reservoirs and Adjacent Strata; [7] Triassic Rift Basins: Preliminary Study of Long-Term CO 2 Storage Potential Together, the regional characterization effort developed useful products to support project developers, policy makers and other stakeholders in the MRCSP region seeking to understand where potential storage exists relative to large stationary sources of CO 2 emissions.

01 COAL, LIGNITE, AND PEAT↗

Penetration Electric Fields and Inner Magnetosphere Dynamics: A Model and Data Comparison

Significant progress has been made on the analysis of the June, 1991 storm. We have completed the analysis of the CRRES and DMSP data sets. We have been able to follow the evolution during the storm of the inner edge of the electric field patterns in the dusk sector and its relation to electron boundaries, ion boundaries and the ring current. Whereas the CRRES data provide radial cuts out through the plasmasphere every I 0 hours, DMSP provides snapshots every orbit of the potential and particle boundaries. Electric field and energetic particle measurements from CRRES and ion drifts and energetic particle measurements from DMSP provide the principal data sets. The combined data set provides high resolution definition of the boundary motions over the phases of the storm. L shell differences between the DMSP and CRRES particle boundaries are easily explained by inflation of the dusk sector by the ring current. The electric field boundaries are typically associated with the ion boundary and the inner edge of the ring current except during rapid increases in the cross-polar cap potential. A significant fraction of the dusk cell potential is found inside the plasmasheet electron inner edge. Twice during the storm this potential exceeded 60 kV. A paper (copy attached) has been prepared (Burke et al., 1998) and submitted to JGR. An invited paper will be presented by Burke at the spring AGU meeting. An abstract has also been submitted to the COSPAR meeting for presentation by Maynard. New simulations have been carried out with the Rice Convection Model for the magnetic storm of June 4-5, 1991, and comparisons have been made with CRRES and DMSP data.

Maynard, Nelson C.↗

Deep Solar Activity Minimum 2007-2009: Solar Wind Properties and Major Effects on the Terrestrial Magnetosphere

We discuss the temporal variations and frequency distributions of solar wind and interplanetary magnetic field parameters during the solar minimum of 2007 - 2009 from measurements returned by the IMPACT and PLASTIC instruments on STEREO-A.We find that the density and total field strength were significantly weaker than in the previous minimum. The Alfven Mach number was higher than typical. This reflects the weakness of magnetohydrodynamic (MHD) forces, and has a direct effect on the solar wind-magnetosphere interactions.We then discuss two major aspects that this weak solar activity had on the magnetosphere, using data from Wind and ground-based observations: i) the dayside contribution to the cross-polar cap potential (CPCP), and ii) the shapes of the magnetopause and bow shock. For i) we find a low interplanetary electric field of 1.3+/-0.9 mV/m and a CPCP of 37.3+/-20.2 kV. The auroral activity is closely correlated to the prevalent stream-stream interactions. We suggest that the Alfven wave trains in the fast streams and Kelvin-Helmholtz instability were the predominant agents mediating the transfer of solar wind momentum and energy to the magnetosphere during this three-year period. For ii) we determine 328 magnetopause and 271 bow shock crossings made by Geotail, Cluster 1, and the THEMIS B and C spacecraft during a three-month interval when the daily averages of the magnetic and kinetic energy densities attained their lowest value during the three years under survey.We use the same numerical approach as in Fairfield's empirical model and compare our findings with three magnetopause models. The stand-off distance of the subsolar magnetopause and bow shock were 11.8 R(sub E) and 14.35 R(sub E), respectively. When comparing with Fairfield's classic result, we find that the subsolar magnetosheath is thinner by approx. 1 R(sub E). This is mainly due to the low dynamic pressure which results in a sunward shift of the magnetopause. The magnetopause is more flared than in Fairfield's model. By contrast the bow shock is less flared, and the latter is the result of weaker MHD forces.

solar minimum↗

Simulation study of particle transport by weakly coherent mode in the Alcator C-Mod tokamak

A simulation study has been conducted of the physical mechanisms behind the weakly coherent mode (WCM) and its produced particle transport in the I-mode edge plasmas by using the BOUT++ code. The WCM is identified in our simulations by its poloidal and radial distributions as well as its frequency and wavenumber spectra. Its produced radial particle flux is calculated and compared with the experimental value. The good agreement indicates that the WCM is an important particle transport channel in the I-mode pedestal. It is found that the WCM can transport particles across the strong outer shear layer of the Er well established in the formation of I-mode, based on which a possible explanation is provided why I-mode does not feature a density pedestal. The key point lies in the change of the cross-phase between the electric potential and density fluctuations induced by the E × B Doppler shift. In the strong shear layer, although the electric potential fluctuation is significantly suppressed, the cross-phase is close to π/2, resulting in a strong drive of the density fluctuation and particle transport. To identify the physical nature of the WCM, a linear dispersion relation for drift Alfvén modes is derived in the slab geometry. A drift Alfvén wave instability is found to have similar dependence to the simulated linear instability behind the WCM on the resistivity and the parallel electron pressure gradient and thermal force terms in the parallel Ohm's law.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

MESSENGER Observations of Magnetic Reconnection in Mercury's Magnetosphere

During MESSENGER'S second flyby of Mercury on October 6,2008, very intense reconnection was observed between the planet's magnetic field and a steady southward interplanetary magnetic field (IMF). The dawn magnetopause was threaded by a strong magnetic field normal to its surface, approx.14 nT, that implies a rate of reconnection approx.10 times the typical rate at Earth and a cross-magnetospheric electric potential drop of approx.30 kV. The highest magnetic field observed during this second flyby, approx.160 nT, was found at the core of a large dayside flux transfer event (FTE). This FTE is estimated to contain magnetic flux equal to approx.5% that of Mercury's magnetic tail or approximately one order of magnitude higher fraction of the tail flux than is typically found for FTEs at Earth. Plasmoid and traveling compression region (TCR) signatures were observed throughout MESSENGER'S traversal of Mercury's magnetotail with a repetition rate comparable to the Dungey cycle time of approx.2 min. The TCR signatures changed from south-north, indicating tailward motion, to north-south, indicating sunward motion, at a distance approx.2.6 RM (where RM is Mercury's radius) behind the terminator indicating that the near-Mercury magnetotail neutral line was crossed at that point. Overall, these new MESSENGER observations suggest that magnetic reconnection at the dayside magnetopause is very intense relative to what is found at Earth and other planets, while reconnection in Mercury's tail is similar to that in other planetary magnetospheres, but with a very short Dungey cycle time.

Slavin. James A.↗

Contributions of the low-latitude boundary layer to the finite width magnetotail convection model

Convection of plasma within the terrestrial nightside plasma sheet contributes to the structure and, possibly, the dynamical evolution of the magnetotail. In order to characterize the steady state convection process, we have extended the finite tail width model of magnetotail plasma sheet convection. The model assumes uniform plasma sources and accounts for both the duskward gradient/curvature drift and the earthward E x B drift of ions in a two-dimensional magnetic geometry. During periods of slow convection (i.e., when the cross-tail electric potential energy is small relative to the source plasma's thermal energy), there is a significant net duskward displacement of the pressure-bearing ions. The electrons are assumed to be cold, and we argue that this assumption is appropriate for plasma sheet parameters. We generalize solutions previously obtained along the midnight meridian to describe the variation of the plasma pressure and number density across the width of the tail. For a uniform deep-tail source of particles, the plasma pressure and number density are unrealistically low along the near-tail dawn flank. We therefore add a secondary source of plasma originating from the dawnside low-latitude boundary layer (LLBL). The dual plasma sources contribute to the plasma pressure and number density throughout the magnetic equatorial plane. Model results indicate that the LLBL may be a significant source of near-tail central plasma sheet plasma during periods of weak convection. The model predicts a cross-tail pressure gradient from dawn to dusk in the near magnetotail. We suggest that the plasma pressure gradient is balanced in part by an oppositely directed magnetic pressure gradient for which there is observational evidence. Finally, the pressure to number density ratio is used to define the plasma 'temperature.' We stress that such quantities as temperature and polytropic index must be interpreted with care as they lose their nominal physical significance in regions where the two-source plasmas intermix appreciably and the distributions become non-Maxwellian.

Spence, H. E.↗

Insight Into the High-Potential Branch of the Alternate Nad+-Dependent NADPH:Ferredoxin Oxidoreductase II (NfnII) from Pyrococcus Furiosus. Evidence for the Gating Step in Electron Bifurcation

We have investigated the rapid-reaction kinetics of the NAD+-dependent NADPH:ferredoxin oxidoreductase II (NfnII) from Pyrococcus furiosus, permitting a comparison with recent work done with the paralog NfnI from the same organism. The half-potentials of the electron-bifurcating L-FAD are highly crossed in both NfnI, meaning the potential for the quinone/semiquinone couple is significantly lower than that for the semiquinone/hydroquinone couple so that the semiquinone oxidation state is thermodynamically unstable. The same appears to be the case with NfnII on the basis of its similar behavior in transient absorption spectroscopy experiments and the absence of any evidence for FAD*- accumulation in the course of reductive titrations (which would be manifested as a transient increase in absorbance at ~380 nm)1. Reductive titrations with both the one-electron donor sodium dithionite and the obligate two-electron donor NADPH demonstrate that, in contrast to NfnI, little FADH* accumulates in the high-potential pathway of NfnII in the course of reduction, as reflected in the absence of a transient increase in absorbance in the 500-600 nm region. This indicates that the half-potentials of the S-FAD are crossed in NfnII by a minimum of 120 mV. Rapid-reaction experiments mixing oxidized NfnII with NADPH also show no evidence of S-FADH* accumulation. Furthermore, the enzyme is only partially reduced at the end of the reaction with NADPH, indicating that there is little electron transfer into the high-potential pathway of NfnII. When the reaction is carried out in the presence of the one-electron carrier ferredoxin, only approximately one equivalent of ferredoxin becomes reduced, in contrast to the maximum of three equivalents seen with NfnI. This is consistent with only a single electron bifurcation event taking place under these conditions with NfnII, with only a single high-potential electron passing into the [2Fe-2S] cluster of the high-potential pathway of NfnII but not progressing further to the S-FAD. This accounts for the observation that NfnII has greatly reduced bifurcating activity compared to NfnI. The lack of electron transfer into the S-FAD of NfnII due to its crossed half-potentials prevents successive bifurcation activity and indicates that electron transfer within the high-potential branch gates bifurcation activity in NfnI.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Estimating Downward Cross-Tropopause Ozone Flux using Column Ozone and Potential Vorticity

A new method of estimating the downward ozone flux across the midlatitude tropopause is introduced. The algorithm derives the estimate from total column ozone observations. Vertical information is given by analysis potential vorticity fields. This method yields an annual estimate of 500 +/- 140 Tg/yr stratospheric injection of ozone into the northern hemisphere, midlatitude troposphere. The downward ozone flux exhibits the expected spring maximum and autumn minimum. The annual distribution of the cross-tropopause ozone, transport by latitude is consistent with the seasonal frequency and (list distribution) of baroclinic systems. This algorithm also produces localized results and call thus be applied to a single case or global studies.

Olsen, Mark A.↗

On the distribution of source coherency in subsonic jets

Recent experimental and theoretical studies on the sources of far field noise generated by subsonic circular jets have given convincing indications that a coherent wave motion does exist in the potential core of subsonic jets. Cross-covariance measurements using single and cross hot-wire probes in the potential core as well as the turbulent mixing region and microphone measurements in the far field have resulted in cross-correlation coefficients of sufficiently high magnitudes to indicate that significant, if not dominant, noise sources may be located in the potential core. The paper presents the analytical and experimental results of this research.

Seiner, J. M.↗

Atomically Precise Hexanuclear Ce(IV) Clusters as Functional Fluorescent Nanosensors for Rapid One-Step Detection of PFAS

Here, the presence of poly- and perfluoroalkyl substances (PFAS) in the environment is associated with adverse health effects but measuring PFAS is challenging due to the associated high cost and technical complexities of the analysis. Here, the reactivity of atomically precise metal-oxo clusters is reported and the foundation for their use is provided as fluorescent nanosensors for PFAS detection. The material comprises crystalline, water soluble, hexanuclear cerium-oxo clusters [Ce 6 (µ 3 -O) 4 (µ 3 -OH) 4 ] 12+ decorated with glycine molecules (Ce-Gly) characterized by fluorescence emission at 353 nm. The Ce-Gly fluorescence is found sensitive to long chain carboxylated PFAS of CF 3 –(CF 2 ) n –, where n ≥ 6, such as perfluorooctanoic, perfluorononanoic and perfluorodecanoic acids. This unique reactivity leads to a change in the emission spectra in a concentration dependent manner, enabling PFAS detection through ligand exchange and aggregation-induced emission (AIE) enhancement. No significant cross-reactivity from potentially co-existing species, including sulfonated PFAS, octanoic and dodecanoic acids, humic acid, and inorganic ions is observed. With an optimal concentration of 3.3 µg mL -1 Ce-Gly, the method demonstrated detection limits of 0.24 ppb for PFOA and 0.4 ppb for PFNA. These findings highlight the potential of fluorescence-based detection strategies utilizing nanoscale probes such as Ce-Gly as fluorescent probes and nanosensors for PFAS.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Review of condensed matter laser cooling using electric-dipole-allowed transitions

The cooling of solids via laser-excited anti-Stokes luminescence has reached the cryogenic regime and is now being considered for several applications that benefit from vibration-free cryogenic refrigeration. 4f-4f transitions in rare-earth-doped crystals with low phonon energies currently offer the best laser-cooling performance. These transitions, however, are electric-dipole (ED) forbidden and thus have low cross sections, limiting the minimum achievable temperatures in practical materials to the 50–100 K regime. In contrast, ED-allowed transitions may offer greater cross sections and potentially enable lower minimum temperatures or more compact devices. The search for laser cooling with ED-allowed transitions has been an active field of research over the past decades with a wide variety of materials having been studied. This paper reviews the fundamentals of solid-state laser cooling, provides a preliminary theoretical assessment showing that laser-cooling with ED-allowed transitions is in principle possible, and reviews the experimental results reported to date. While cooling with ED-allowed transitions has not yet been realized in the solid state, the existing experimental body of work along with the theoretical considerations presented here suggest that further research on this topic may be fruitful.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗