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At least 1,081 records · Page 60

Direct prediction of nonlinear tearing mode saturation using a variational principle

It is shown that the variational principle of multi-region relaxed magnetohydrodynamics (MRxMHD) can be used to predict the stability and nonlinear saturation of tearing modes in strong guide field configurations without resolving the dynamics and without explicit dependence on the plasma resistivity. While the magnetic helicity is not a good invariant for tearing modes, we show that the saturated tearing mode can be obtained as an MRxMHD state of a priori unknown helicity by appropriately constraining the current profile. The predicted saturated island width in a tearing-unstable force-free slab equilibrium is shown to reproduce the theoretical scaling at small values of Δ' and the scaling obtained from resistive magnetohydrodynamics simulations at large Δ'.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Variational design principles for nonequilibrium colloidal assembly

Using large deviation theory and principles of stochastic optimal control, we show that rare molecular dynamics trajectories conditioned on assembling a specific target structure encode a set of interactions and external forces that lead to enhanced stability of that structure. Such a relationship can be formulated into a variational principle, for which we have developed an associated optimization algorithm and have used it to determine optimal forces for targeted self-assembly within nonequilibrium steady-states. We illustrate this perspective on inverse design in a model of colloidal cluster assembly within linear shear flow. We find that colloidal clusters can be assembled with high yield using specific short-range interactions of tunable complexity. Shear decreases the yields of rigid clusters, while small values of shear increase the yields of nonrigid clusters. The enhancement or suppression of the yield due to shear is rationalized with a generalized linear response theory. Furthermore, by studying 21 unique clusters made of six, seven, or eight particles, we uncover basic design principles for targeted assembly out of equilibrium.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Tree tensor network hierarchical equations of motion based on time-dependent variational principle for efficient open quantum dynamics in structured thermal environments

In this work, we introduce an efficient method, TTN-HEOM, for exactly calculating the open quantum dynamics for driven quantum systems interacting with highly structured bosonic baths by combining the tree tensor network (TTN) decomposition scheme with the bexcitonic generalization of the numerically exact hierarchical equations of motion (HEOM). The method yields a series of quantum master equations for all core tensors in the TTN that efficiently and accurately capture the open quantum dynamics for non-Markovian environments to all orders in the system–bath interaction. These master equations are constructed based on the time-dependent Dirac–Frenkel variational principle, which isolates the optimal dynamics for the core tensors given the TTN ansatz. The dynamics converges to the HEOM when increasing the rank of the core tensors, a limit in which the TTN ansatz becomes exact. We introduce TENSO, tensor equations for non-Markovian structured open systems, as a general-purpose Python code to propagate the TTN-HEOM dynamics. We implement three general propagators for the coupled master equations: two fixed-rank methods that require a constant memory footprint during the dynamics and one adaptive-rank method with a variable memory footprint controlled by the target level of computational error. We exemplify the utility of these methods by simulating a two-level system coupled to a structured bath containing one Drude–Lorentz component and eight Brownian oscillators, which is beyond what can presently be computed using the standard HEOM. Our results show that the TTN-HEOM is capable of simulating both dephasing and relaxation dynamics of driven quantum systems interacting with structured baths, even those of chemical complexity, with an affordable computational cost.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Variations in the output characteristics of broadband superluminescent diodes during long-term operation

A method of service life tests of SLD-37 quantum-well superluminescent diodes (SLDs), which are widely used in optical coherence tomography, is described and the results of tests are presented. Special attention is given to variations in the emission spectra of SLDs during their aging. It is shown that this method can be used as an incoming test to select processed semiconductor heterostructures with the longest expected lifetime for fabrication of active elements of SLD modules. (lasers)

36 MATERIALS SCIENCE↗

Variation of the equilibrium energy and the S-property of stationary compact sets

This paper studies a variation of the equilibrium energy for a certain fairly general functional which appears naturally in the solution of many rational approximation problems of multi-valued analytic functions. The main result of this work states that for the energy functional under consideration and a certain class of admissible compact sets, related to the function to be approximated, the corresponding stationary compact set is fully characterized by the so-called S-property. Bibliography: 38 titles.

97 MATHEMATICS AND COMPUTING↗

Discovery of a novel amino acid racemase through exploration of natural variation in Arabidopsis thaliana

Plants produce diverse low-molecular-weight compounds via specialized metabolism. Discovery of the pathways underlying production of these metabolites is an important challenge for harnessing the huge chemical diversity and catalytic potential in the plant kingdom for human uses, but this effort is often encumbered by the necessity to initially identify compounds of interest or purify a catalyst involved in their synthesis. Here, as an alternative approach, we have performed untargeted metabolite profiling and genome-wide association analysis on 440 natural accessions of Arabidopsis thaliana . This approach allowed us to establish genetic linkages between metabolites and genes. Investigation of one of the metabolite-gene associations led to the identification of N-malonyl-D-allo-isoleucine, and the discovery of a novel amino acid racemase involved in its biosynthesis. This finding provides, to our knowledge, the first functional characterization of a eukaryotic member of a large and widely conserved phenazine biosynthesis protein PhzF-like protein family. Unlike most of known eukaryotic amino acid racemases, the newly discovered enzyme does not require pyridoxal 5'-phosphate for its activity. In conclusion, this study thus identifies a new d-amino acid racemase gene family and advances our knowledge of plant d-amino acid metabolism that is currently largely unexplored. As a result, it also demonstrates that exploitation of natural metabolic variation by integrating metabolomics with genome-wide association is a powerful approach for functional genomics study of specialized metabolism.

59 BASIC BIOLOGICAL SCIENCES↗

Barrierless association of CF 2 and dissociation of C 2 F 4 by variational transition-state theory and system-specific quantum Rice–Ramsperger–Kassel theory

Bond dissociation is a fundamental chemical reaction, and the first principles modeling of the kinetics of dissociation reactions with a monotonically increasing potential energy along the dissociation coordinate presents a challenge not only for modern electronic structure methods but also for kinetics theory. In this work, we use multifaceted variable-reaction-coordinate variational transition-state theory (VRC-VTST) to compute the high-pressure limit dissociation rate constant of tetrafluoroethylene (C 2 F 4 ), in which the potential energies are computed by direct dynamics with the M08-HX exchange correlation functional. To treat the pressure dependence of the unimolecular rate constants, we use the recently developed system-specific quantum Rice–Ramsperger–Kassel theory. The calculations are carried out by direct dynamics using an exchange correlation functional validated against calculations that go beyond coupled-cluster theory with single, double, and triple excitations. In conclusion, our computed dissociation rate constants agree well with the recent experimental measurements.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

A Variational Nodal Approach to 2D/1D Pin Resolved Neutron Transport for Pressurized Water Reactors

A two-dimensional/one-dimensional (2D/1D) variational nodal approach is presented for pressurized water reactor core calculations without fuel-moderator homogenization. A 2D/1D approximation to the within-group neutron transport equation is derived and converted to an even-parity form. The corresponding nodal functional is presented and discretized to obtain response matrix equations. Within the nodes, finite elements in the x-y plane and orthogonal functions in z are used to approximate the spatial flux distribution. On the radial interfaces, orthogonal polynomials are employed; on the axial interfaces, piecewise constants corresponding to the finite elements eliminate the interface homogenization that has been a challenge for method of characteristics (MOC)-based 2D/1D approximations. The angular discretization utilizes an even-parity integral method within the nodes, and low-order spherical harmonics (P N ) on the axial interfaces. The x-y surfaces are treated with high-order P N combined with quasi-reflected interface conditions. Furthermore, the method is applied to the C5G7 benchmark problems and compared to Monte Carlo reference calculations.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

WIND STRUCTURE AND LUMINOSITY VARIATIONS IN THE WOLF-RAYET/LUMINOUS BLUE VARIABLE HD 5980

Over the past 40 years, the massive luminous blue variable/Wolf-Rayet system HD 5980 in the Small Magellanic Cloud (SMC) has undergone a long-term S Doradus-type variability cycle and two brief and violent eruptions in 1993 and 1994. In this paper we analyze a collection of UV and optical spectra obtained between 1979 and 2009 and perform CMFGEN model fits to spectra of 1994, 2000, 2002, and 2009. The results are as follows: (1) the long-term S Dor-type variability is associated with changes of the hydrostatic radius; (2) the 1994 eruption involved changes in its bolometric luminosity and wind structure; (3) the emission-line strength, the wind velocity, and the continuum luminosity underwent correlated variations in the sense that a decreasing V{sub {infinity}} is associated with increasing emission line and continuum levels; and (4) the spectrum of the third star in the system (Star C) is well fit by a T{sub eff} = 32 K model atmosphere with SMC chemical abundances. For all epochs, the wind of the erupting star is optically thick at the sonic point and is thus driven mainly by the continuum opacity. We speculate that the wind switches between two stable regimes driven by the 'hot' (during the eruption) and the 'cool' (post-eruption) iron opacity bumps as defined by Lamers and Nugis and Graefener and Hamann, and thus the wind may undergo a bi-stability jump of a different nature from that which occurs in OB stars.

79 ASTRONOMY AND ASTROPHYSICS↗

Physical nature and timing variations of the eclipsing system V407 Pegasi

New multiband CCD photometry is presented for V407 Peg; the R {sub C} light curves are the first ever compiled. Our light curves, displaying a flat bottom at secondary minimum and an O'Connell effect, were simultaneously analyzed with the radial velocity (RV) curves given by Rucinski et al. The light changes of the system are best modeled using both a hot spot on the secondary star and a third light. The model also represents historical light curves. All available minimum epochs, including our six timing measurements, have been examined and they indicate that the eclipse timing variation is mainly caused by light asymmetries due to the spot activity detected in the light-curve synthesis. The hot spot may be produced as a result of the impact of the gas stream from the primary star. Our light and velocity solutions indicate that V407 Peg is a totally eclipsing A-type overcontact binary with values of q = 0.251, i = 87.°6, ΔT = 496 K, f = 61%, and l {sub 3} = 11∼16%. Individual masses and radii of both components are determined to be M {sub 1} = 1.72 M {sub ☉}, M {sub 2} = 0.43 M {sub ☉}, R {sub 1} = 2.15 R {sub ☉}, and R {sub 2} = 1.21 R {sub ☉}. These results are very different from previous ones, which is probably caused by the light curves with distorted and inclined eclipses used in those other analyses. The fact that there are no objects optically related to the system and that the seasonal RVs show a large discrepancy in systemic velocity indicates that the third light source most likely arises from a tertiary component orbiting the eclipsing pair.

79 ASTRONOMY AND ASTROPHYSICS↗

The massive star population in M101. II. Spatial variations in the recent star formation history

We investigate star formation history (SFH) as a function of radius in M101 using archival Hubble Space Telescope Advanced Camera for Surveys photometry. We derive the SFH from the resolved stellar populations in five 2' wide annuli. Binning the SFH into time frames corresponding to stellar populations traced by Hα, far-ultraviolet, and near-ultraviolet emission, we find that the fraction of stellar populations young enough to contribute in Hα is 15%-35% in the inner regions, compared to less than 5% in the outer regions. This provides a sufficient explanation for the lack of Hα emission at large radii. We also model the blue to red supergiant ratio in our five annuli, examine the effects that a metallicity gradient and variable SFH have on the predicted ratios, and compare to the observed values. We find that the radial behavior of our modeled blue to red supergiant ratios is highly sensitive to both spatial variations in the SFH and metallicity. Incorporating the derived SFH into modeled ratios, we find that we are able to reproduce the observed values at large radii (low metallicity), but at small radii (high metallicity) the modeled and observed ratios are discrepant.

79 ASTRONOMY AND ASTROPHYSICS↗

EXPLORING ANTICORRELATIONS AND LIGHT ELEMENT VARIATIONS IN NORTHERN GLOBULAR CLUSTERS OBSERVED BY THE APOGEE SURVEY

We investigate the light-element behavior of red giant stars in northern globular clusters (GCs) observed by the SDSS-III Apache Point Observatory Galactic Evolution Experiment. We derive abundances of 9 elements (Fe, C, N, O, Mg, Al, Si, Ca, and Ti) for 428 red giant stars in 10 GCs. The intrinsic abundance range relative to measurement errors is examined, and the well-known C–N and Mg–Al anticorrelations are explored using an extreme-deconvolution code for the first time in a consistent way. We find that Mg and Al drive the population membership in most clusters, except in M107 and M71, the two most metal-rich clusters in our study, where the grouping is most sensitive to N. We also find a diversity in the abundance distributions, with some clusters exhibiting clear abundance bimodalities (for example M3 and M53) while others show extended distributions. The spread of Al abundances increases significantly as cluster average metallicity decreases as previously found by other works, which we take as evidence that low metallicity, intermediate mass AGB polluters were more common in the more metal-poor clusters. The statistically significant correlation of [Al/Fe] with [Si/Fe] in M15 suggests that {sup 28}Si leakage has occurred in this cluster. We also present C, N, and O abundances for stars cooler than 4500 K and examine the behavior of A(C+N+O) in each cluster as a function of temperature and [Al/Fe]. The scatter of A(C+N+O) is close to its estimated uncertainty in all clusters and independent of stellar temperature. A(C+N+O) exhibits small correlations and anticorrelations with [Al/Fe] in M3 and M13, but we cannot be certain about these relations given the size of our abundance uncertainties. Star-to-star variations of α-element (Si, Ca, Ti) abundances are comparable to our estimated errors in all clusters.

79 ASTRONOMY AND ASTROPHYSICS↗

SOLAR CYCLE VARIATION IN SUN-AS-A-STAR Ca II 854.2 nm BISECTORS

The bisector of the strong chromospheric Ca II 854.2 nm line has an inverse-C shape, the cause of which is not yet fully understood. We show that the amplitude of the bisector in Sun-as-a-star observations exhibits a solar cycle variation with smaller amplitudes during highest activity. The line core intensity is lower during solar minima while the part of the bisector most sensitive to the line core shows no systematic change with activity. Our results support the use of Ca II 854.2 nm bisectors in studying the relationship between convection and magnetic fields, not only in the Sun but in other stars as well.

79 ASTRONOMY AND ASTROPHYSICS↗

TWENTY-ONE NEW LIGHT CURVES OF OGLE-TR-56b: NEW SYSTEM PARAMETERS AND LIMITS ON TIMING VARIATIONS

Although OGLE-TR-56b was the second transiting exoplanet discovered, only one light curve, observed in 2006, has been published besides the discovery data. We present 21 light curves of 19 different transits observed between 2003 July and 2009 July with the Magellan Telescopes and Gemini South. The combined analysis of the new light curves confirms a slightly inflated planetary radius relative to model predictions, with R{sub p} = 1.378 {+-} 0.090 R{sub J} . However, the values found for the transit duration, semimajor axis, and inclination values differ significantly from the previous result, likely due to systematic errors. The new semimajor axis and inclination, a = 0.01942 {+-} 0.00015 AU and i = 73.{sup 0}72 {+-} 0.{sup 0}18, are smaller than previously reported, while the total duration, T{sub 14} = 7931 {+-} 38 s, is 18 minutes longer. The transit midtimes have errors from 23 s to several minutes, and no evidence is seen for transit midtime or duration variations. Similarly, no change is seen in the orbital period, implying a nominal stellar tidal decay factor of Q{sub *} = 10{sup 7}, with a 3{sigma} lower limit of 10{sup 5.7}.

79 ASTRONOMY AND ASTROPHYSICS↗

THE CORRELATION BETWEEN H{alpha} EMISSION AND VISUAL MAGNITUDE DURING LONG-TERM VARIATIONS IN CLASSICAL Be STARS

H{alpha} equivalent widths and UBV magnitudes are calculated for Be star disk models that grow in size and/or density with time. We show that these simple models are consistent with the known Be star classes of positive and inverse correlations between long-term variations in H{alpha} and V magnitude as identified by Harmanec. We support the conclusion of Harmanec that the distinction is controlled by the inclination of the disk to the line of sight. We demonstrate that the strength of these correlations, particularly those of an inverse correlation where the system becomes fainter as the H{alpha} emission strength grows, is strongly influenced by the scale height of the inner Be star disk and the extent of the gravitational darkening of the central B star due to rapid rotation. This dependence may allow coordinated spectroscopic and photometric observations to better constrain these poorly known Be star parameters.

79 ASTRONOMY AND ASTROPHYSICS↗

Characterization of the KOI-94 system with transit timing variation analysis: Implication for the planet-planet eclipse

The KOI-94 system is a closely packed, multi-transiting planetary system discovered by the Kepler space telescope. It is known as the first system that exhibited a rare event called a 'planet-planet eclipse (PPE)', in which two planets partially overlap with each other in their double-transit phase. In this paper, we constrain the parameters of the KOI-94 system with an analysis of the transit timing variations (TTVs). Such constraints are independent of the radial velocity (RV) analysis recently performed by Weiss and coworkers, and valuable in examining the reliability of the parameter estimate using TTVs. We numerically fit the observed TTVs of KOI-94c, KOI-94d, and KOI-94e for their masses, eccentricities, and longitudes of periastrons, and obtain the best-fit parameters including m{sub c}=9.4{sub −2.1}{sup +2.4} M{sub ⊕}, m{sub d}=52.1{sub −7.1}{sup +6.9} M{sub ⊕}, m{sub e}=13.0{sub −2.1}{sup +2.5} M{sub ⊕}, and e ≲ 0.1 for all the three planets. While these values are mostly in agreement with the RV result, the mass of KOI-94d estimated from the TTV is significantly smaller than the RV value m {sub d} = 106 ± 11 M {sub ⊕}. In addition, we find that the TTV of the outermost planet KOI-94e is not well reproduced in the current modeling. We also present analytic modeling of the PPE and derive a simple formula to reconstruct the mutual inclination of the two planets from the observed height, central time, and duration of the brightening caused by the PPE. Based on this model, the implication of the results of TTV analysis for the time of the next PPE is discussed.

79 ASTRONOMY AND ASTROPHYSICS↗

The range of variation of the mass of the most massive star in stellar clusters derived from 35 million Monte Carlo simulations

A growing fraction of simple stellar population models, in an aim to create more realistic simulations capable of including stochastic variation in their outputs, begin their simulations with a distribution of discrete stars following a power-law function of masses. Careful attention is needed to create a correctly sampled initial mass function (IMF), and here we provide a solid mathematical method, called MASSCLEAN IMF Sampling, for doing so. We use our method to perform 10 million MASSCLEAN Monte Carlo stellar cluster simulations to determine the most massive star in a mass distribution as a function of the total mass of the cluster. We find that a maximum mass range is predicted, not a single maximum mass. This range is (1) dependent on the total mass of the cluster and (2) independent of an upper stellar mass limit, M{sub limit} , for unsaturated clusters and emerges naturally from our IMF sampling method. We then turn our analysis around, starting with our new database of 25 million simulated clusters, to constrain the highest mass star from the observed integrated colors of a sample of 40 low-mass Large Magellanic Cloud stellar clusters of known age and mass. Finally, we present an analytical description of the maximum mass range of the most massive star as a function of the cluster's total mass and present a new M{sub max} -M{sub cluster} relation.

79 ASTRONOMY AND ASTROPHYSICS↗

Densities and eccentricities of 139 Kepler planets from transit time variations

We extract densities and eccentricities of 139 sub-Jovian planets by analyzing transit time variations (TTVs) obtained by the Kepler mission through Quarter 12. We partially circumvent the degeneracies that plague TTV inversion with the help of an analytical formula for the TTV. From the observed TTV phases, we find that most of these planets have eccentricities of the order of a few percent. More precisely, the rms eccentricity is 0.018{sub −0.004}{sup +0.005}, and planets smaller than 2.5 R {sub ⊕} are around twice as eccentric as those bigger than 2.5 R {sub ⊕}. We also find a best-fit density-radius relationship ρ ≈ 3 g cm{sup –3} × (R/3 R {sub ⊕}){sup –2.3} for the 56 planets that likely have small eccentricity and hence small statistical correction to their masses. Many planets larger than 2.5 R {sub ⊕} are less dense than water, implying that their radii are largely set by a massive hydrogen atmosphere.

79 ASTRONOMY AND ASTROPHYSICS↗