Poly[[tetra­kis­(μ2-pyrazine N,N′-dioxide-κ2 O:O′)holmium(III)] tris­(perchlorate)]

The title three-dimensional coordination network, {[Ho(C4H4N2O2)4](ClO4)3}n, is isostructural to that of other lanthanides. The Ho+3 cation lies on a fourfold roto-inversion axis. It is coordinated in a distorted square anti-prismatic fashion by eight O atoms from bridging pyrazine N,N′-dioxide ligands. There are two unique pyrazine N,N′-dioxide ligands. One ring is located around an inversion center, and there is a a twofold rotation axis at the center of the other ring. There are also two unique perchlorate anions. One is centered on a twofold rotation axis and the other on a fourfold roto-inversion axis. The perchlorate anions are located in channels that run perpendicular to (001) (110) and inter­act with the coordination network through C—H⋯O hydrogen bonds

X-ray spectral modelling of the AGN obscuring region in the CDFS: Bayesian model selection and catalogue

AGN are known to have complex X-ray spectra that depend on both the properties of the accreting SMBH (e.g. mass, accretion rate) and the distribution of obscuring material in its vicinity ("torus"). Often however, simple and even unphysical models are adopted to represent the X-ray spectra of AGN. In the case of blank field surveys in particular, this should have an impact on e.g. the determination of the AGN luminosity function, the inferred accretion history of the Universe and also on our understanding of the relation between AGN and their host galaxies. We develop a Bayesian framework for model comparison and parameter estimation of X-ray spectra. We take into account uncertainties associated with X-ray data and photometric redshifts. We also demonstrate how Bayesian model comparison can be used to select among ten different physically motivated X-ray spectral models the one that provides a better representation of the observations. Despite the use of low-count spectra, our methodology is able to draw strong inferences on the geometry of the torus. For a sample of 350 AGN in the 4 Ms Chandra Deep Field South field, our analysis identifies four components needed to represent the diversity of the observed X-ray spectra: (abridged). Simpler models are ruled out with decisive evidence in favour of a geometrically extended structure with significant Compton scattering. Regarding the geometry of the obscurer, there is strong evidence against both a completely closed or entirely open toroidal geometry, in favour of an intermediate case. The additional Compton reflection required by data over that predicted by toroidal geometry models, may be a sign of a density gradient in the torus or reflection off the accretion disk. Finally, we release a catalogue with estimated parameters such as the accretion luminosity in the 2-10 keV band and the column density, $N_{H}$, of the obscurer.Comment: 28 pages, 18 figures, catalogue available from https://www.mpe.mpg.de/~jbuchner/agn_torus/analysis/cdfs4Ms_cat/, software available from https://github.com/JohannesBuchner/BX

Overexpression of a NAC transcription factor delays leaf senescence and increases grain nitrogen concentration in wheat

Increasing the duration of leaf photosynthesis during grain filling using slow-senescing functional stay-green phenotypes is a possible route for increasing grain yields in wheat (Triticum aestivum L.). However, delayed senescence may negatively affect nutrient remobilisation and hence reduce grain protein concentrations and grain quality. A novel NAC1-type transcription factor (hereafter TaNAC-S) was identified in wheat, with gene expression located primarily in leaf/sheath tissues, which decreased during post-anthesis leaf senescence. Expression of TaNAC-S in the second leaf correlated with delayed senescence in two doubled-haploid lines of an Avalon 3 Cadenza population (lines 112 and 181), which were distinct for leaf senescence. Transgenic wheat plants overexpressing TaNAC-S resulted in delayed leaf senescence (stay-green phenotype). Grain yield, aboveground biomass, harvest index and total grain N content were unaffected, but NAC over-expressing lines had higher grain N concentrations at similar grain yields compared to non-transgenic controls. These results indicate that TaNAC-S is a negative regulator of leaf senescence, and that delayed leaf senescence may lead not only to increased grain yields but also to increased grain protein concentrations.D. Zhao, A. P. Derkx, D.-C. Liu, P. Buchner, M. J. Hawkesfor

Poly[[tetra­kis­(μ2-pyrazine N,N′-dioxide-κ2 O:O′)erbium(III)] tris­(perchlorate)]

The title three-dimensional coordination network, {[Er(C4H4N2O2)4](ClO4)3}n, is isostructural to that of other lanthanides. The Er+3 cation lies on a fourfold roto-inversion axis. It is coordinated in a distorted square-anti­prismatic fashion by eight O atoms from bridging pyrazine N,N′-dioxide ligands. There are two unique pyrazine N,N′-dioxide ligands. One ring is located around an inversion center, and there is a a twofold rotation axis at the center of the other ring. There are also two unique perchlorate anions. One is centered on a twofold rotation axis and the other on a fourfold roto-inversion axis. The perchlorate anions are located in channels that run perpendicular to (001) and (110) and inter­act with the coordination network through C—H⋯O hydrogen bonds

X-ray bolometric corrections for Compton-thick active galactic nuclei

We present X-ray bolometric correction factors, $\kappa_{Bol}$ ($\equiv L_{Bol}/L_X$), for Compton-thick (CT) active galactic nuclei (AGN) with the aim of testing AGN torus models, probing orientation effects, and estimating the bolometric output of the most obscured AGN. We adopt bolometric luminosities, $L_{Bol}$, from literature infrared (IR) torus modeling and compile published intrinsic 2--10 keV X-ray luminosities, $L_{X}$, from X-ray torus modeling of NuSTAR data. Our sample consists of 10 local CT AGN where both of these estimates are available. We test for systematic differences in $\kappa_{Bol}$ values produced when using two widely used IR torus models and two widely used X-ray torus models, finding consistency within the uncertainties. We find that the mean $\kappa_{Bol}$ of our sample in the range $L_{Bol}\approx10^{42}-10^{45}$ erg/s is log$_{10}\kappa_{Bol}=1.44\pm0.12$ with an intrinsic scatter of $\sim0.2$ dex, and that our derived $\kappa_{Bol}$ values are consistent with previously established relationships between $\kappa_{Bol}$ and $L_{Bol}$ and $\kappa_{Bol}$ and Eddington ratio. We investigate if $\kappa_{Bol}$ is dependent on $N_H$ by comparing our results on CT AGN to published results on less-obscured AGN, finding no significant dependence. Since many of our sample are megamaser AGN, known to be viewed edge-on, and furthermore under the assumptions of AGN unification whereby unobscured AGN are viewed face-on, our result implies that the X-ray emitting corona is not strongly anisotropic. Finally, we present $\kappa_{Bol}$ values for CT AGN identified in X-ray surveys as a function of their observed $L_X$, where an estimate of their intrinsic $L_{X}$ is not available, and redshift, useful for estimating the bolometric output of the most obscured AGN across cosmic time.Comment: Accepted for publication in Ap

New Spectral Model for Constraining Torus Covering Factors from Broadband X-ray Spectra of Active Galactic Nuclei

The basic unified model of active galactic nuclei (AGN) invokes an anisotropic obscuring structure, usually referred to as a torus, to explain AGN obscuration as an angle-dependent effect. We present a new grid of X-ray spectral templates based on radiative transfer calculations in neutral gas in an approximately toroidal geometry, appropriate for CCD-resolution X-ray spectra (FWHM > 130 eV). Fitting the templates to broadband X-ray spectra of AGN provides constraints on two important geometrical parameters of the gas distribution around the supermassive black hole: the average column density and the covering factor. Compared to the currently available spectral templates, our model is more flexible, and capable of providing constraints on the main torus parameters in a wider range of AGN. We demonstrate the application of this model using hard X-ray spectra from NuSTAR (3-79 keV) for four AGN covering a variety of classifications: 3C 390.3, NGC 2110, IC 5063, and NGC 7582. This small set of examples was chosen to illustrate the range of possible torus configurations, from disk-like to sphere-like geometries with column densities below, as well as above, the Compton-thick threshold. This diversity of torus properties challenges the simple assumption of a standard geometrically and optically thick toroidal structure commonly invoked in the basic form of the unified model of AGN. Finding broad consistency between the our constraints and those from infrared modeling, we discuss how the approach from the X-ray band complements similar measurements of AGN structures at other wavelengths.Comment: Accepted for publication in ApJ. Model fits files are available at http://www.astro.caltech.edu/~mislavb/downloa

X-ray constraints on the fraction of obscured AGN at high accretion luminosities

The wide-area XMM-XXL X-ray survey is used to explore the fraction of obscured AGN at high accretion luminosities, $L_X (\rm 2-10 \, keV) > 10^{44} \, erg \,s ^{-1}$, and out to redshift $z\approx1.5$. The sample covers an area of about $\rm14\,deg^2$ and provides constraints on the space density of powerful AGN over a wide range of neutral hydrogen column densities extending beyond the Compton-thick limit, $\rm N_H\approx10^{24}\,cm^{-2}$. The fraction of obscured Compton-thin ($\rm N_H=10^{22}-10^{24}\,cm^{-2}$) AGN is estimated to be $\approx0.35$ for luminosities $L_X(\rm 2-10\,keV)>10^{44}\,erg\,s^{-1}$ independent of redshift. For less luminous sources the fraction of obscured Compton-thin AGN increases from $0.45\pm0.10$ at $z=0.25$ to $0.75\pm0.05$ at $z=1.25$. Studies that select AGN in the infrared via template fits to the observed Spectral Energy Distribution of extragalactic sources estimate space densities at high accretion luminosities consistent with the XMM-XXL constraints. There is no evidence for a large population of AGN (e.g. heavily obscured) identified in the infrared and missed at X-ray wavelengths. We further explore the mid-infrared colours of XMM-XXL AGN as a function of accretion luminosity, column density and redshift. The fraction of XMM-XXL sources that lie within the mid-infrared colour wedges defined in the literature to select AGN is primarily a function of redshift. This fraction increases from about 20-30% at z=0.25 to about 50-70% at $z=1.5$.Comment: MNRAS accepte

Instantaneous Normal Mode analysis of liquid HF

We present an Instantaneous Normal Modes analysis of liquid HF aimed to clarify the origin of peculiar dynamical properties which are supposed to stem from the arrangement of molecules in linear hydrogen-bonded network. The present study shows that this approach is an unique tool for the understanding of the spectral features revealed in the analysis of both single molecule and collective quantities. For the system under investigation we demonstrate the relevance of hydrogen-bonding ``stretching'' and fast librational motion in the interpretation of these features.Comment: REVTeX, 7 pages, 5 eps figures included. Minor changes in the text and in a figure. Accepted for publication in Phys. Rev. Let