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At least 757 records · Page 42

High-energy radiation damage in zirconia: Modeling results

Zirconia is viewed as a material of exceptional resistance to amorphization by radiation damage, and consequently proposed as a candidate to immobilize nuclear waste and serve as an inert nuclear fuel matrix. Here, we perform molecular dynamics simulations of radiation damage in zirconia in the range of 0.1–0.5 MeV energies with account of electronic energy losses. We find that the lack of amorphizability co-exists with a large number of point defects and their clusters. These, importantly, are largely isolated from each other and therefore represent a dilute damage that does not result in the loss of long-range structural coherence and amorphization. We document the nature of these defects in detail, including their sizes, distribution, and morphology, and discuss practical implications of using zirconia in intense radiation environments.

36 MATERIALS SCIENCE↗

Permanent polarization and charge distribution in organic light-emitting diodes (OLEDs): Insights from near-infrared charge-modulation spectroscopy of an operating OLED

Vapor-deposited Alq{sub 3} layers typically possess a strong permanent electrical polarization, whereas NPB layers do not. (Alq{sub 3} is tris(8-quinolinolato)aluminum(III); NPB is 4,4′-bis[N-(1-naphthyl)-N-phenylamino]biphenyl.) The cause is a net orientation of the Alq{sub 3} molecules with their large dipole moments. Here we report on consequences for an organic light-emitting diode (OLED) with an NPB hole-transport layer and Alq{sub 3} electron-transport layer. The discontinuous polarization at the NPB|Alq{sub 3} interface has the same effect as a sheet of immobile negative charge there. It is more than compensated by a large concentration of injected holes (NPB{sup +}) when the OLED is running. We discuss the implications and consequences for the quantum efficiency and the drive voltage of this OLED and others. We also speculate on possible consequences of permanent polarization in organic photovoltaic devices. The concentration of NPB{sup +} was measured by charge-modulation spectroscopy (CMS) in the near infrared, where the NPB{sup +} has a strong absorption band, supplemented by differential-capacitance and current-voltage measurements. Unlike CMS in the visible, this method avoids complications from modulation of the electroluminescence and electroabsorption.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Quantum interference in polyenes

The explicit form of the zeroth Green's function in the Hückel model, approximated by the negative of the inverse of the Hückel matrix, has direct quantum interference consequences for molecular conductance. We derive a set of rules for transmission between two electrodes attached to a polyene, when the molecule is extended by an even number of carbons at either end (transmission unchanged) or by an odd number of carbons at both ends (transmission turned on or annihilated). These prescriptions for the occurrence of quantum interference lead to an unexpected consequence for switches which realize such extension through electrocyclic reactions: for some specific attachment modes the chemically closed ring will be the ON position of the switch. Normally the signs of the entries of the Green's function matrix are assumed to have no physical significance; however, we show that the signs may have observable consequences. In particular, in the case of multiple probe attachments – if coherence in probe connections can be arranged – in some cases new destructive interference results, while in others one may have constructive interference. One such case may already exist in the literature.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Coulomb and even-odd effects in cold and super-asymmetric fragmentation for thermal neutron induced fission of {sup 235}U

Even-odd effects of the maximal total kinetic energy (K{sub max}) as a function of charge (Z) and mass (A) of fragments from thermal neutron induced fission of actinides are questioned by other authors. In this work, visiting old results on thermal neutron induced fission of {sup 235}U, those even-odd effects are reconfirmed. The cases seeming to contradict even-odd effects are interpreted with the Coulomb effect hypothesis. According to Coulomb effect hypothesis, K{sub max} is equal to the Coulomb interaction energy of the most compact scission configuration. As a consequence, between two isobaric charge splits with similar Q-values, the more asymmetrical one will get the more compact scission configuration and then it will reach the higher K{sub max}-value. In some cases, the more asymmetrical charge split corresponds, by coincidence, to an odd charge split; consequently its higher K{sub max}-value may be misinterpreted as anti-even-odd effect. Another experimental result reported in the literature is the increasing of even-odd effects on charge distribution on the more asymmetrical fragmentations region. In this region, the difference between K{sub max} and Q-values increases with asymmetry, which means that the corresponding scission configuration needs higher total deformation energy to occur. Higher deformation energy of the fragments implies lower free energy to break nucleon pairs. Consequently, in the asymmetric fragmentation region, the even-odd effects of the distribution of proton number and neutron number must increase with asymmetry.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Correlation between Epitaxial Strain and Magnetic Properties in La0.7Sr0.3CoO3/La0.7Sr0.3MnO3 bilayers

Magnetic properties arising at interfaces of perovskite oxides such as La0.7Sr0.3MnO3 (LSMO) and La0.7Sr0.3CoO3 (LSCO) depend sensitively on the fine details of their structural properties. In this work, we use high-resolution transmission electron microscopy and spectroscopy to examine the structural and electronic phenomena at the interfaces in two LSMO/LSCO bilayers with reversed growth order. Two different strain mechanisms are at work in these films; compressive or tensile epitaxial strain, and distortion of the octahedral tilt pattern to maintain the network of corner-sharing octahedra. While the epitaxial strain is constant, regardless of growth order, the modification of the octahedral tilt pattern depends on whether the film is grown directly on the substrate, or as the second sublayer. As a consequence, exchange spring behavior is observed only when the LSCO sublayer is grown first. The different mechanisms of strain accommodation within the oxygen octahedra network in each material prove to be of critical importance in determining the interfacial structure and thus magnetic and electronic properties of the bilayers.

perovskites, interfaces, microscopy, magnetism↗

Multiple and fast: The accretion of ordinary chondrite parent bodies

Although petrologic, chemical, and isotopic studies of ordinary chondrites and meteorites in general have largely helped establish a chronology of the earliest events of planetesimal formation and their evolution, there are several questions that cannot be resolved via laboratory measurements and/or experiments alone. Here, we propose the rationale for several new constraints on the formation and evolution of ordinary chondrite parent bodies (and, by extension, most planetesimals) from newly available spectral measurements and mineralogical analysis of main-belt S-type asteroids (83 objects) and unequilibrated ordinary chondrite meteorites (53 samples). Based on the latter, we suggest that spectral data may be used to distinguish whether an ordinary chondrite was formed near the surface or in the interior of its parent body. If these constraints are correct, the suggested implications include that: (1) large groups of compositionally similar asteroids are a natural outcome of planetesimal formation and, consequently, meteorites within a given class can originate from multiple parent bodies; (2) the surfaces of large (up to ∼200 km) S-type main-belt asteroids mostly expose the interiors of the primordial bodies, a likely consequence of impacts by small asteroids (D < 10 km) in the early solar system; (3) the duration of accretion of the H chondrite parent bodies was likely short (instantaneous or in less than ∼10{sup 5} yr, but certainly not as long as 1 Myr); (4) LL-like bodies formed closer to the Sun than H-like bodies, a possible consequence of the radial mixing and size sorting of chondrules in the protoplanetary disk prior to accretion.

79 ASTRONOMY AND ASTROPHYSICS↗

The typecasting of active galactic nuclei: Mrk 590 no longer fits the role

We present multiwavelength observations that trace more than 40 yr in the life of the active galactic nucleus (AGN) in Mrk 590, traditionally known as a classic Seyfert 1 galaxy. From spectra recently obtained from Hubble Space Telescope, Chandra, and the Large Binocular Telescope, we find that the activity in the nucleus of Mrk 590 has diminished so significantly that the continuum luminosity is a factor of 100 lower than the peak luminosity probed by our long-baseline observations. Furthermore, the broad emission lines, once prominent in the UV/optical spectrum, have all but disappeared. Since AGN type is defined by the presence of broad emission lines in the optical spectrum, our observations demonstrate that Mrk 590 has now become a 'changing-look' AGN. If classified by recent optical spectra, Mrk 590 would be a Seyfert ∼1.9–2, where the only broad emission line still visible in the optical spectrum is a weak component of Hα. As an additional consequence of this change, we have definitively detected UV narrow-line components in a Type 1 AGN, allowing an analysis of these emission-line components with high-resolution COS spectra. These observations challenge the historical paradigm that AGN type is only a consequence of the line-of-sight viewing angle toward the nucleus in the presence of a geometrically flattened, obscuring medium (i.e., the torus). Our data instead suggest that the current state of Mrk 590 is a consequence of the change in luminosity, which implies the black hole accretion rate has significantly decreased.

79 ASTRONOMY AND ASTROPHYSICS↗

Leptogenesis scenarios for natural SUSY with mixed axion-higgsino dark matter

Supersymmetric models with radiatively-driven electroweak naturalness require light higgsinos of mass ∼100–300 GeV. Naturalness in the QCD sector is invoked via the Peccei-Quinn (PQ) axion leading to mixed axion-higgsino dark matter. The SUSY DFSZ axion model provides a solution to the SUSY μ problem and the Little Hierarchy μ≪m{sub 3/2} may emerge as a consequence of a mismatch between PQ and hidden sector mass scales. The traditional gravitino problem is now augmented by the axino and saxion problems, since these latter particles can also contribute to overproduction of WIMPs or dark radiation, or violation of BBN constraints. We compute regions of the T{sub R} vs. m{sub 3/2} plane allowed by BBN, dark matter and dark radiation constraints for various PQ scale choices f{sub a}. These regions are compared to the values needed for thermal leptogenesis, non-thermal leptogenesis, oscillating sneutrino leptogenesis and Affleck-Dine leptogenesis. The latter three are allowed in wide regions of parameter space for PQ scale f{sub a}∼10{sup 10}–10{sup 12} GeV which is also favored by naturalness: f{sub a}∼√(μM{sub P}/λ{sub μ})∼10{sup 10}–10{sup 12} GeV. These f{sub a} values correspond to axion masses somewhat above the projected ADMX search regions.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

A Multi-frequency analysis of dark matter annihilation interpretations of recent anti-particle and γ-ray excesses in cosmic structures

The Fermi-LAT observation of a γ-ray excess from the galactic-centre, as well as the PAMELA, AMS, and AMS-2 anti-particle excesses, and the recent indications of a Fermi-LAT γ-ray excess in the Reticulum II dwarf galaxy have all been variously put forward as possible indirect signatures of supersymmetric neutralino dark matter. These are of particular interest as the neutralino annihilation models which fit these observations must have observable consequences across the frequency spectrum, from radio to γ-ray emission. Moreover, since dark matter is expected to be a major constituent of cosmic structure, these multi-frequency consequences should be common to such structures across the mass spectrum, from dwarf galaxies to galaxy clusters. Thus, in this work we make predictions for the multi-frequency spectra of three well-known sources dominated by dark matter on cluster, galaxy and dwarf galaxy scales, e.g. the Coma cluster, the galaxy M81, and the Draco dwarf galaxy, using models favoured by dark matter interpretations of the aforementioned observations. We pay special attention to the consequences for these models when their cross-sections are renormalised to reproduce the recent γ-ray excess observed in the Reticulum II dwarf galaxy, as well as using cross-sections from the Fermi-LAT dwarf galaxy limits, which throw a dark matter interpretation of this excess into doubt. We find that the multi-frequency data of Coma and Draco are in conflict with the dark matter interpretation of the AMS, PAMELA and Fermi positron excess. Additionally, models derived from Fermi-LAT galactic centre observations, and AMS-2 re-analysis, present similar but less extensive conflicts. Using the sensitivity projections for the Square Kilometre Array, the Cherenkov Telescope Array, as well as the ASTROGAM and ASTRO-H satellites, we determine the detection prospects for a subset of neutralino models that remain consistent with Planck cosmological constraints. Although the SKA has the greatest sensitivity to dark matter models, we demonstrate that ASTRO-H is well positioned to probe the inverse-Compton scattering emissions from neutralino annihilation and identify characteristics of the spectra which contain information about the neutralino mass and annihilation channel. This means that, given environments with favourable X-ray backgrounds, multi-frequency observation with the next generation of experiments will allow for unprecedented sensitivity to the neutralino parameter space as well as offsetting the individual weaknesses of each observation mode. Finally we show that all of the studied models can be better tested with the SKA phase 1.

79 ASTRONOMY AND ASTROPHYSICS↗

Modified magnetohydrodynamics around the electroweak transition

We analyse solutions of the MHD equations around the electroweak transition taking into account the effects of the chiral anomaly. It is shown that a transition that is not of the first order has direct consequences on the evolution of the asymmetry between left- and right-handed leptons. Assuming an initial chiral asymmetry in the symmetric phase at temperatures higher than the transition temperature, as well as the existence of magnetic fields, it is demonstrated that the asymmetry typically grows with time, until it undergoes a fast decrease at the transition, and then eventually gets damped at lower temperatures in the broken phase. We argue that it is unlikely to have any significant magnetic field amplification as a consequence of the electroweak transition in the Standard model, even when the chiral anomaly is introduced. The presence of a chiral asymmetry between left- and right-handed charge carriers naturally leads to the creation of helical magnetic fields from non-helical fields and this can have consequences on their subsequent evolution. Similarly, an initially vanishing chiral asymmetry is naturally created in the presence of a helical magnetic field.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Monodromy Dark Matter

Light pseudo-Nambu-Goldstone bosons (pNGBs) such as, e.g. axion-like particles, that are non-thermally produced via the misalignment mechanism are promising dark matter candidates. An important feature of pNGBs is their periodic potential, whose scale of periodicity controls their couplings. As a consequence of the periodicity the maximal potential energy is limited and, hence, producing the observed dark matter density poses significant constraints on the allowed masses and couplings. In the presence of a monodromy, the field range as well as the range of the potential can be significantly extended. As we argue in this paper this has important phenomenological consequences. The constraints on the masses and couplings are ameliorated and couplings to Standard Model particles could be significantly stronger, thereby opening up considerable experimental opportunities. Yet, monodromy models can also give rise to new and qualitatively different features. As a remnant of the periodicity the potential can feature pronounced ''wiggles''. When the field is passing through them quantum fluctuations are enhanced and particles with non-vanishing momentum are produced. Here, we perform a first analysis of this effect and delineate under which circumstances this becomes important. We briefly discuss some possible cosmological consequences.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

A quasi-static approach to structure formation in black hole universes

Motivated by the existence of hierarchies of structure in the Universe, we present four new families of exact initial data for inhomogeneous cosmological models at their maximum of expansion. These data generalise existing black hole lattice models to situations that contain clusters of masses, and hence allow the consequences of cosmological structures to be considered in a well-defined and non-perturbative fashion. The degree of clustering is controlled by a parameter λ, in such a way that for λ ∼ 0 or 1 we have very tightly clustered masses, whilst for λ ∼ 0.5 all masses are separated by cosmological distance scales. We study the consequences of structure formation on the total net mass in each of our clusters, as well as calculating the cosmological consequences of the interaction energies both within and between clusters. The locations of the shared horizons that appear around groups of black holes, when they are brought sufficiently close together, are also identified and studied. We find that clustering can have surprisingly large effects on the scale of the cosmology, with models that contain thousands of black holes sometimes being as little as 30% of the size of comparable Friedmann models with the same total proper mass. This deficit is comparable to what might be expected to occur from neglecting gravitational interaction energies in Friedmann cosmology, and suggests that these quantities may have a significant influence on the properties of the large-scale cosmology.

79 ASTRONOMY AND ASTROPHYSICS↗

Spatial and temporal variation in nest temperatures forecasts sex ratio skews in a crocodilian with environmental sex determination

Species displaying temperature-dependent sex determination (TSD) are especially vulnerable to the effects of a rapidly changing global climate due to their profound sensitivity to thermal cues during development. Predicting the consequences of climate change for these species, including skewed offspring sex ratios, depends on understanding how climatic factors interface with features of maternal nesting behaviour to shape the developmental environment. Here, we measure thermal profiles in 86 nests at two geographically distinct sites in the northern and southern regions of the American alligator's ( Alligator mississippiensis ) geographical range, and examine the influence of both climatic factors and maternally driven nest characteristics on nest temperature variation. Changes in daily maximum air temperatures drive annual trends in nest temperatures, while variation in individual nest temperatures is also related to local habitat factors and microclimate characteristics. Without any compensatory nesting behaviours, nest temperatures are projected to increase by 1.6–3.7°C by the year 2100, and these changes are predicted to have dramatic consequences for offspring sex ratios. Exact sex ratio outcomes vary widely depending on site and emission scenario as a function of the unique temperature-by-sex reaction norm exhibited by all crocodilians. By revealing the ecological drivers of nest temperature variation in the American alligator, this study provides important insights into the potential consequences of climate change for crocodilian species, many of which are already threatened by extinction.

Environmental Sciences & Ecology↗

Extreme matter meets extreme gravity: Ultraheavy neutron stars with phase transitions

The speed of sound of the matter within neutron stars may contain nonsmooth structure related to first- or higher-order phase transitions. Here we investigate what are the observable consequences of structure in the speed of sound, such as bumps, spikes, step functions, plateaus, and kinks. One of the main consequences is the possibility of ultraheavy neutron stars (with masses larger than 2.5 solar masses), mass twins in heavy (with masses larger than 2 solar masses) and ultraheavy neutron stars. These stars pass all observational and theoretical constraints, including those imposed by recent LIGO/Virgo gravitational-wave observations and NICER x-ray observations. Here we thoroughly investigate other consequences of this structure in the speed of sound to develop an understanding of how nonsmooth features affect astrophysical observables, such as stellar radii, tidal deformability, moment of inertia, and Love number. Our results have important implications for future gravitational wave and x-ray observations of neutron stars and their impact in nuclear astrophysics.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Lifetimes and spatio-temporal response of protein crystals in intense X-ray microbeams

Serial synchrotron-based crystallography using intense microfocused X-ray beams, fast-framing detectors and protein microcrystals held at 300 K promises to expand the range of accessible structural targets and to increase overall structure-pipeline throughputs. To explore the nature and consequences of X-ray radiation damage under microbeam illumination, the time-, dose- and temperature-dependent evolution of crystal diffraction have been measured with maximum dose rates of 50 MGy s −1 . At all temperatures and dose rates, the integrated diffraction intensity for a fixed crystal orientation shows non-exponential decays with dose. Non-exponential decays are a consequence of non-uniform illumination and the resulting spatial evolution of diffracted intensity within the illuminated crystal volume. To quantify radiation-damage lifetimes and the damage state of diffracting crystal regions, a revised diffraction-weighted dose (DWD) is defined and it is shown that for Gaussian beams the DWD becomes nearly independent of actual dose at large doses. An apparent delayed onset of radiation damage seen in some intensity–dose curves is in fact a consequence of damage. Intensity fluctuations at high dose rates may arise from the impulsive release of gaseous damage products. Accounting for these effects, data collection at the highest dose rates increases crystal radiation lifetimes near 300 K (but not at 100 K) by a factor of ∼1.5–2 compared with those observed at conventional dose rates. Improved quantification and modeling of the complex spatio-temporal evolution of protein microcrystal diffraction in intense microbeams will enable more efficient data collection, and will be essential in improving the accuracy of structure factors and structural models.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Developing a Reduced 240-Bus WECC Dynamic Model for Frequency Response Study of High Renewable Integration

The ongoing changes in the generation resource mix, driven by the rapid adoption of inverter-based resources (IBR) as well as the early retirement of synchronous generators, are bringing new challenges to the planning and operation of bulk electric power systems. Consequently, there is an increasing need to understand, design, and quantify the reliability service provision from IBRs by performing integrated scheduling and dynamic simulations. However, test systems that have consistent scheduling and dynamic models rarely exist largely because of the decoupled nature of the two simulations on a synchronous generator-dominated system. This paper develops the dynamic model of a reduced Western Electricity Coordinating Council (WECC) system. In conjunction with the existing scheduling model, it is suitable for integrating scheduling and dynamic simulations. The reduced 240-bus WECC model reflects the generation resource mix of the Western Interconnection as of 2018. Moreover, the developed dynamic model is validated against field frequency events measured by FNET/GridEye and preserves the dominant inter-area oscillation mode in WECC.

dynamic simulation↗

Pressurization Analysis for Heating of a Screw Top Utility Can Loaded With Plutonium Oxide Powder by a 1273 K Fire

The documented safety analysis for the Savannah River National Laboratory (SRNL) evaluates the consequences of a postulated 1273 K fire in a glovebox. The radiological dose consequences for a pressurized release of plutonium oxide powder during such a fire depend on the maximum pressure that is attained inside the oxide storage containers. The oxide storage configuration selected for analysis is can/bag/can, comprised of oxide powder inside an 8.38 × 10 -6 m 3 stainless steel B vial inside 0.006 kg of polyethylene bagging inside a one-quart screw top utility can of the type commonly used to package solvents or rubber cements. To enable evaluation of the dose consequences, temperature and pressure transients have been calculated for exposure of a typical set of storage containers to the fire. The pressurization analysis credits venting to and from the B vial but does not credit venting or leakage from the can. Due to the low rate of venting from the B vial into the can gas space, the can pressure is nearly independent of the B vial pressure. Calculated maximum pressures are compared to the utility can burst pressure. In lieu of a structural analysis of the utility cans, burst pressures and leakage rates were measured using compressed nitrogen gas. The measured gauge burst pressure was 0.250 ± 0.043 MPa. The measured burst pressures are lower than the calculated maximum pressure due to fire exposure, indicating that the utility cans could burst during exposure to a 1273 K fire.

98 NUCLEAR DISARMAMENT, SAFEGUARDS, AND PHYSICAL P↗

An integrated approach to geological disposal of UK wastes containing carbon-14

Carbon-14 is a key radionuclide in the assessment of the safety of a geological disposal facility for radioactive waste because of the calculated assessment of the radiological consequences of gaseous carbon-14 bearing species [i]. It may be that such calculations are based on overly conservative assumptions and that better understanding could lead to considerably reduced assessment of the radiological consequences from these wastes. Alternatively, it may be possible to mitigate the impact of these wastes through alternative treatment, packaging or design options. The Radioactive Waste Management Directorate of the UK's Nuclear Decommissioning Authority (NDA RWMD) has established an integrated project team in which the partners are working together to develop a holistic approach to carbon-14 management in the disposal system [ii]. For a waste stream containing carbon-14 to be an issue: There must be a significant inventory of carbon-14 in the waste stream; and That waste stream has to generate carbon-14 bearing gas; and a bulk gas phase has to entrain the carbon-14 bearing gas: and these gases must migrate through the engineered barriers in significant quantities; and these gases must migrate through the overlying geological environment (either as a distinct gas phase or as dissolved gas); and these gases must interact with materials in the biosphere (i.e. plants) in a manner that leads to significant doses and risks to exposed groups or potentially exposed groups. The project team has developed and used this 'and' approach to structure and prioritise the technical work and break the problem down in a manageable way. We have also used it to develop our approach to considering alternative treatment, packaging and design options. For example, it may be possible to pre-treat some wastes to remove some of the inventory or to segregate other wastes so that they are removed from any bulk gas phase which might facilitate migration through the geosphere. Initially, the project team has undertaken a six month programme of work to examine the current understanding of these aspects and has captured this in the Phase 1 report [ii], in a modelling basis spreadsheet and in scoping assessments, which help us better understand the potential significance of carbon-14. Using the current modelling basis, but ignoring any potential benefits from the geosphere in retarding or preventing gas from reaching the surface, the calculated release of carbon- 14 is dominated by: corrosion of irradiated reactive metals (in the operational and early post-closure time frame); corrosion of irradiated stainless steel and leaching of irradiated graphite (in the longer term). The Phase 1 work has shown that there is considerable scope for reducing the calculated radiological consequence for these wastes and a roadmap has been developed for a second Phase of work. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗