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2019-08-16
Itinerant ferromagnetism and intrinsic anomalous Hall effect in amorphous iron-germanium
The amorphous iron-germanium system ($a$-Fe$_x$Ge$_{1-x}$) lacks long-range structural order and hence lacks a meaningful Brillouin zone. The magnetization of \aFeGe is well explained by the Stoner model for Fe concentrations $x$ above the onset of magnetic order around $x=0.4$, indicating that the local order of the amorphous structure preserves the spin-split density of states of the Fe-$3d$ states sufficiently to polarize the electronic structure despite $\mathbf{k}$ being a bad quantum number. Measurements reveal an enhanced anomalous Hall resistivity $\rho_{xy}^{\mathrm{AH}}$ relative to crystalline FeGe; this $\rho_{xy}^{\mathrm{AH}}$ is compared to density functional theory calculations of the anomalous Hall conductivity to resolve its underlying mechanisms. The intrinsic mechanism, typically understood as the Berry curvature integrated over occupied $\mathbf{k}$-states but shown here to be equivalent to the density of curvature integrated over occupied energies in aperiodic materials, dominates the anomalous Hall conductivity of $a$-Fe$_x$Ge$_{1-x}$ ($0.38 \leq x \leq 0.61$). The density of curvature is the sum of spin-orbit correlations of local orbital states and can hence be calculated with no reference to $\mathbf{k}$-space. This result and the accompanying Stoner-like model for the intrinsic anomalous Hall conductivity establish a unified understanding of the underlying physics of the anomalous Hall effect in both crystalline and disordered systems.
1908.06055v3
2019-08-21
Stellar population astrophysics (SPA) with the TNG. GIANO-B spectroscopy of red supergiants in Alicante 7 and Alicante 10
The Scutum complex in the inner disk of the Galaxy hosts a number of young clusters and associations of red supergiant stars that are heavily obscured by dust extinction. These stars are important tracers of the recent star formation and chemical enrichment history in the inner Galaxy. Within the SPA Large Programme at the TNG, we secured GIANO-B high-resolution (R=50,000) YJHK spectra of 11 red supergiants toward the Alicante 7 and Alicante 10 associations near the RSGC3 cluster. Taking advantage of the full YJHK spectral coverage of GIANO in a single exposure, we were able to measure several hundreds of atomic and molecular lines that are suitable for chemical abundance determinations. We also measured a prominent diffuse interstellar band at lambda=1317.8 nm (vacuum). This provides an independent reddening estimate. The radial velocities, Gaia proper motions, and extinction of seven red supergiants in Alicante 7 and three in Alicante 10 are consistent with them being members of the associations. One star toward Alicante 10 has kinematics and low extinction that are inconsistent with a membership. By means of spectral synthesis and line equivalent width measurements, we obtained chemical abundances for iron-peak, CNO, alpha, other light, and a few neutron-capture elements. We found average slightly subsolar iron abundances and solar-scaled [X/Fe] abundance patterns for most of the elements, consistent with a thin-disk chemistry. We found depletion of [C/Fe], enhancement of [N/Fe], and relatively low 12C/13C<15, which is consistent with CN cycled material and possibly some additional mixing in their atmospheres.
1908.07779v1
2019-08-28
Neutrino halo effect on collective neutrino oscillation in iron core-collapse supernova model of a 9.6 $M_{\odot}$ star
We extend the multi-angle computational framework and investigate the time evolution of the neutrino halo on collective neutrino oscillation in the core collapse of an iron core progenitor. We find that in the case of the $9.6\, \rm M_\odot$ progenitor adopted in this work, there are windows of time when the effects of neutrino halo and collective neutrino oscillation are not simultaneously large. Inside the shock, the impact of the inward-scattered halo neutrino cannot in general be neglected compared to the outward-propagating neutrino flux. However, during early epochs, collective neutrino oscillation is effectively shut down by multi-angle matter suppression. During the intermediate epoch, collective neutrino oscillation is not suppressed, but its onset radius is beyond the still relatively small explosion shock front where the halo is prominent. We also find in the case of the $9.6\, \rm M_\odot$ progenitor the halo neutrinos induce a delay in the onset of collective neutrino oscillations. This causes novel flavor conversions which sharpen collective neutrino oscillation spectral features. We predict that the inclusion of neutrino halo effects makes neutrino signals that are more clearly distinct from thermal emission that when halo neutrinos are omitted.
1908.10594v2
2019-09-04
Multi-epoch X-ray spectral analysis of the narrow-line Seyfert 1 galaxy Mrk 478
A multi-epoch X-ray spectral and variability analysis is conducted for the narrow-line Seyfert 1 (NLS1) active galactic nucleus (AGN) Mrk 478. All available X-ray data from XMM-Newton and Suzaku satellites, spanning from 2001 to 2017, are modelled with a variety of physical models including partial covering, soft-Comptonisation, and blurred reflection, to explain the observed spectral shape and variability over the 16 years. All models are a similar statistical fit to the data sets, though the analysis of the variability between data sets favours the blurred reflection model. In particular, the variability can be attributed to changes in flux of the primary coronal emission. Different reflection models fit the data equally well, but differ in interpretation. The use of reflionx predicts a low disc ionisation and power law dominated spectrum, while relxill predicts a highly ionised and blurred reflection dominated spectrum. A power law dominated spectrum might be more consistent with the normal X-ray-to-UV spectral shape (aox). Both blurred reflection models suggest a rapidly spinning black hole seen at a low inclination angle, and both require a sub-solar (~0.5) abundance of iron. All physical models require a narrow emission feature at 6.7 keV likely attributable to Fe xxv emission, while no evidence for a narrow 6.4 keV line from neutral iron is detected.
1909.01897v1
2019-09-16
Ferrovolcanism on metal worlds and the origin of pallasites
As differentiated planetesimals cool, their cores can solidify from the outside-in, as evidenced by paleomagnetic measurements and cooling rate estimates of iron meteorites. The details of outside-in solidification and fate of residual core melt are poorly understood. For a core primarily composed of Fe and Ni alloyed with lighter constituent elements, like sulfur, such inward core growth would likely be achieved by growth of solid FeNi dendrites. Growth of FeNi dendrites results in interconnected pockets of residual melt that become progressively enriched in sulfur up to a eutectic composition of 31 wt percent sulfur as FeNi continues to solidify. Here we show that regions of residual sulfur-enriched FeNi melt in the core attain sufficient excess pressures to propagate via dikes into the mantle. Thus, core material will intrude into the overlying rocky mantle or possibly even erupt onto the plantesimals surface. We refer to these processes collectively as ferrovolcanism. Our calculation show that ferrovolcanic surface eruptions are more likely on bodies with mantles less than 50 km thick. We show that intrusive ferromagmatism can produce pallasites, an enigmatic class of meteorites composed of olivine crystals entrained in a matrix of FeNi metal. Ferrovolcanic eruptions may explain the observations that Psyche has a bulk density inconsistent with iron metorites yet shows evidence of a metallic surface composition.
1909.07451v1
2019-09-24
Strongly correlated superconductor with polytypic 3D Dirac points
Topological superconductors should be able to provide essential ingredients for quantum computing, but are very challenging to realize. Spin-orbit interaction in iron-based superconductors opens the energy gap between the $p$-states of pnictogen and $d$-states of iron very close to the Fermi level, and such $p$-states have been recently experimentally detected. Density functional theory predicts existence of topological surface states within this gap in FeTe$_{1-x}$Se$_x$ making it an attractive candidate material. Here we use synchrotron-based angle-resolved photoemission spectroscopy and band structure calculations to demonstrate that FeTe$_{1-x}$Se$_x$ (x=0.45) is a superconducting 3D Dirac semimetal hosting type-I and type-II Dirac points and that its electronic structure remains topologically trivial. We show that the inverted band gap in FeTe$_{1-x}$Se$_x$ can possibly be realized by further increase of Te content, but strong correlations reduce it to a sub-meV size, making the experimental detection of this gap and corresponding topological surface states very challenging, not to mention exact matching with the Fermi level. On the other hand, the $p-d$ and $d-d$ interactions are responsible for the formation of extremely flat band at the Fermi level pointing to its intimate relation with the mechanism of high-T$_c$ superconductivity in IBS.
1909.10806v2
2019-11-08
Oxygen Reduction Reaction and X-ray Photoelectron Spectroscopy of Sputtered Fe-N-C Films
Electrocatalysts for the oxygen reduction reaction (ORR) based on complexes of iron and nitrogen in a carbon matrix (Fe-N-C) are a promising alternative to platinum group metal (PGM) based catalysts in polymer electrolyte membrane (PEM) fuel cells. Further improvements of Fe-N-C catalysts would benefit from model thin film studies of activity and stability of catalytic sites, but synthesis of Fe-N-C model thin films is challenging. Here we report on synthesis and characterization of Fe-N-C thin films produced by co-sputtering iron and carbon in a reactive nitrogen atmosphere onto removable glassy carbon rotating disk electrode (RDE) tips. Scanning electron microscopy (SEM) measurements indicate that the Fe-N-C films deposited at high temperature are smoother than the films annealed at high temperature. ORR activity measured on the thin Fe-N-C films is greater for both high-temperature samples than for the room-temperature sample. From the analysis of X-ray photoelectron spectroscopy (XPS) data, exposure of the films to high temperatures results in increased graphitization of the carbon with the Fe-N-C films, and increased relative amount of graphitic and hydrogenated nitrogen species. Overall the results of this study demonstrate the feasibility of a thin film model system approach for studying active sites in PGM-free catalysts.
1911.03368v1
2019-11-14
The Chemical Evolution of Iron-Peak Elements with Hypernovae
We calculate the mean evolution of the iron-peak abundance ratios [(Cr,Mn,Co,Zn)/Fe] in the Galaxy, using modern supernova and hypernova chemical yields and a Galactic Chemical Evolution code that assumes homogeneous chemical evolution. We investigate a range of hypernova occurrence rates and are able to produce a chemical composition that is a reasonable fit to the observed values in metal-poor stars. This requires a hypernova occurence rate that is large (50%) in the early Universe, decreasing throughout evolution to a value that is within present day observational constraints (>~ 1%). A large hypernova occurence rate is beneficial to matching the high [Zn/Fe] observed in the most metal-poor stars, although including hypernovae with progenitor mass >= 60 solar masses is detrimental to matching the observed [(Mn,Co)/Fe] evolution at low [Fe/H]. A significant contribution from HNe seems to be critical for producing supersolar [(Co,Zn)/Fe] at low metallicity, though more work will need to be done in order to match the most extreme values. We also emphasise the need to update models for the enrichment sources at higher metallicity, as the satisfactory recovery of the solar values of [(Cr,Mn,Co,Zn)/Fe] still presents a challenge.
1911.05901v2
2019-11-21
Weakness of Correlation Effect Manifestation in BaNi$_2$As$_2$: ARPES and LDA+DMFT study
The electronic spectral function of BaNi$_2$As$_2$ is investigated using both the angle-resolved photoemission spectroscopy (ARPES) and a combined computational scheme of local density approximation together with dynamical mean-field theory (LDA+DMFT). In contrast to well studied isostructural iron arsenide high temperature superconductors, the BaNi$_2$As$_2$ demonstrate weak correlation effects although Ni-3d elections have even lager on-site interaction than Fe-3d ones. LDA+DMFT effective mass enhancement for bands crossing the Fermi level is found to be only about $1.2$ which agrees well with ARPES data. This reduction of the correlation manifestation with respect to iron pnictides comes from the increase of 3d-orbital filling, when going from Fe to Ni. The electron correlations cause remarkable reconstruction of the bare BaNi$_2$As$_2$ LDA band structure below $-0.8$ eV due to self-energy effect. A simplified toy model to understand weakness of correlation effects in BaNi$_2$As$_2$ and to describe the LDA+DMFT self-energy shape is discussed. For more realistic comparison of LDA+DMFT spectral function maps with ARPES data we take into account several experimental features: the photoemission cross-section, the experimental energy and angular resolutions and the photo-hole lifetime effects. Thus presented here LDA+DMFT calculations with experimental features included provide nearly qualitative agreement with ARPES data and assure the observation of a dramatic apparent decrease of the correlation strength compared to the Fe compounds.
1911.09300v2
2020-01-03
Disappearance of the Fe K$α$ emission line in Ultra Compact X-ray Binaries 4U 1543-624 and Swift J1756.9-2508
We investigate the long-term variability of the K$\alpha$ line of iron in the spectra of two Ultra Compact X-ray Sources (UCXBs) with C/O-rich donors. We revisit archival observations by five different X-ray telescopes, over a ~twenty year period. Adopting physically motivated models for the spectral continuum, we probe the long-term evolution of the source emission in a self-consistent manner enabling physical interpretation of potential variability in the primary X-ray emission continuum and/or any emission lines from reflection off the accretion disk. We find that the spectral shape and flux of the source emission (for both objects) has remained almost constant throughout all the observations, displaying only minor variability in some spectral parameters and the source flux (largest variation is a ~25% drop in the flux of Swift J1756.9-2508). We note a striking variability of the Fe K$\alpha$ line which fluctuates from a notable equivalent width of ~66-100 eV in 4U 1543-624 and ~170 eV in Swift J1756.9-2508, to non-detections with upper limits of 2-8 eV. We argue that the disappearance of the iron line is due to the screening of the Fe K$\alpha$ line by the overabundant oxygen in the C/O-rich UCXBs. This effect is cancelled when oxygen becomes fully ionized in the inner disk region, resulting in the variability of the Fe K$\alpha$ line in an otherwise unaltered spectral shape. This finding supports earlier predictions on the consequences of H-poor, C/O-rich accretion disk on reflection induced fluorescent lines in the spectra of UCXBs.
2001.00713v2
2020-01-06
Are Faint Supernovae Responsible for Carbon-Enhanced Metal-Poor Stars?
Mixing and fallback models in faint supernova models are supposed to reproduce the abundance patterns of observed carbon-enhanced metal-poor (CEMP) stars in the Galactic halo. A fine tuning of the model parameters for individual stars is required to reproduce the observed ratios of carbon to iron. We focus on extremely metal-poor stars formed out of the ejecta from the mixing and fallback models using a chemical evolution model. Our chemical evolution models take into account the contribution of individual stars to chemical enrichment in host halos together with their evolution in the context of the hierarchical clustering. Parametrized models of mixing and fallback models for Pop. III faint supernovae are implemented in the chemical evolution models with merger trees to reproduce the observed CEMP stars. A variety of choices for model parameters on star formation and metal-pollution by faint supernovae is unable to reproduce the observed stars with [Fe/H] < -4 and [C/H] > -2, which are the majority of CEMP stars among the lowest metallicity stars. Only possible solution is to form stars from small ejecta mass, which produces an inconsistent metallicity distribution function. We conclude that not all the CEMP stars are explicable by the mixing and fallback models. We also tested the contribution of binary mass transfers from AGB stars that are also supposed to reproduce the abundances of known CEMP stars. This model reasonably reproduces the distribution of carbon and iron abundances simultaneously only if we assume that long-period binaries are favored at [Fe/H] < -3.5.
2001.01420v1
2020-02-09
A detailed study on the reflection component for the Black Hole Candidate MAXI J1836-194
We present a detailed spectral analysis of the black hole candidate MAXI J1836-194. The source was caught in the intermediate state during its 2011 outburst by Suzaku and RXTE. We jointly fit the X-ray data from these two missions using the relxill model to study the reflection component, and a steep inner emissivity profile indicating a compact corona as the primary source is required in order to achieve a good fit. In addition, a reflection model with a lamp-post configuration (relxilllp), which is normally invoked to explain the steep emissivity profile, gives a worse fit and is excluded at 99% confidence level compared to relxill. We also explore the effect of the ionization gradient on the emissivity profile by fitting the data with two relativistic reflection components, and it is found that the inner emissivity flattens. These results may indicate that the ionization state of the disc is not constant. All the models above require a supersolar iron abundance higher than 4.5. However, we find that the high-density version of reflionx can describe the same spectra even with solar iron abundance well. A moderate rotating black hole (a* = 0.84-0.94) is consistently obtained by our models, which is in agreement with previously reported values.
2002.03315v1
2020-02-11
AstroSat/LAXPC view of GX 17+2: Spectral Evolution along the Z-track
In this paper, we present the first results obtained using $\sim$ 50 ks observations of the bright low-mass X-ray binary (LMXB) GX 17+2 with Large Area X-ray Proportional Counter (LAXPC) onboard {\it AstroSat}. The source traced out a complete Z-track in the hardness intensity diagram (HID). The spectra at different sections of the Z-diagram are well described by either a combination of a thermal Comptonization component, a power-law and a relativistic iron line or a model consisting of a thermal disk component, a single temperature blackbody, a power-law and a relativistic iron line. Fitting the spectra with both phenomenological models suggests that the power-law component is strong in the horizontal branch (HB), becomes weaker as the source moves down the normal branch (NB) and then again becomes stronger as the sources moves up the flaring branch (FB). However, we find that the strength of the power-law component is model dependent, although the trend in the variation of the power-law strength along the Z-track is similar. A simple model composed by a Comptonized emission and power-law component, convolved with the ionized reflection, also describes the spectra very well. A normal branch oscillation (NBO) with a centroid frequency 7.42$\pm$0.23 Hz, quality factor (Q) $\sim$ 4.88, rms 1.41$\pm$0.29\% and significance 5.1$\sigma$ is detected at the middle of the NB. The parameters of the Comptonized emission show a systematic evolution along the Z-diagram. The optical depth of the corona increases as the source moves up along the FB, suggesting possible trigger of an outflow or dumping of the disc material in to the corona by radiation pressure.
2002.04489v1
2020-02-18
The Solar wind prevents re-accretion of debris after Mercury's giant impact
The planet Mercury possesses an anomalously large iron core, and a correspondingly high bulk density. Numerous hypotheses have been proposed in order to explain such a large iron content. A long-standing idea holds that Mercury once possessed a larger silicate mantle which was removed by a giant impact early in the the Solar system's history. A central problem with this idea has been that material ejected from Mercury is typically re-accreted onto the planet after a short (~Myr) timescale. Here, we show that the primordial Solar wind would have provided sufficient drag upon ejected debris to remove them from Mercury-crossing trajectories before re-impacting the planet's surface. Specifically, the young Sun likely possessed a stronger wind, fast rotation and strong magnetic field. Depending upon the time of the giant impact, the ram pressure associated with this wind would push particles outward into the Solar system, or inward toward the Sun, on sub-Myr timescales, depending upon the size of ejected debris. Accordingly, the giant impact hypothesis remains a viable pathway toward the removal of planetary mantles, both on Mercury and extrasolar planets, particularly those close to young stars with strong winds.
2002.07847v2
2020-02-20
Chemical Diversity of Super-Earths As a Consequence of Formation
Recent observations of rocky super-Earths have revealed an apparent wider distribution of Fe/Mg ratios, or core to mantle ratios, than the planets in our Solar System. This study aims to understand how much of the chemical diversity in the super-Earth population can arise from giant impacts during planetary formation. Planet formation simulations have only recently begun to treat collisions more realistically in an attempt to replicate the planets in our Solar System. We investigate planet formation more generally by simulating the formation of rocky super-Earths with varying initial conditions using a version of SyMBA, a gravitational N-body code, that incorporates realistic collisions. We track the maximum plausible change in composition after each impact. The final planets span a range of Fe/Mg ratios similar to the Solar System planets, but do not completely match the distribution in super-Earth data. We only form a few planets with minor iron-depletion, suggesting other mechanisms are at work. The most iron-rich planets have a lower Fe/Mg ratio than Mercury, and are less enriched than planets such as Kepler-100b. This indicates that further work on our understanding of planet formation and further improvement of precision of mass and radius measurements are required to explain planets at the extremes of this Fe/Mg distribution.
2002.09042v1
2020-04-17
Thermodynamic signatures of an antiferromagnetic quantum critical point inside a superconducting dome
Recent experiments in unconventional superconductors, and in particular iron-based materials, have reported evidence of an antiferromagnetic quantum critical point (AFM-QCP) emerging inside the superconducting dome of the phase diagram. Fluctuations associated with such an AFM-QCP are expected to promote unusual temperature dependencies of thermodynamic quantities. Here, we compute the $T$ dependence of the specific heat $C(T)$ deep inside a fully gapped $s^{+-}$ superconducting state as the AFM-QCP is approached. We find that, at the AFM-QCP, the specific heat $C(T)$ vanishes quadratically with temperature, as opposed to the typical exponential suppression seen in fully-gapped BCS superconductors. This robust result is due to a non-analytic contribution to the free-energy arising from the general form of the bosonic (AFM) propagator in the SC state. Away from the AFM-QCP, as temperature is lowered, $C(T)$ shows a crossover from a $T^2$ behavior to an exponential behavior, with the crossover temperature scale set by the value of the superconducting gap and the distance to the QCP. We argue that these features in the specific heat can be used to unambiguously determine the existence of AFM-QCPs inside the superconducting domes of iron-based and other fully gapped unconventional superconductors.
2004.08300v3
2020-04-22
Crystal structures of Fe-gluconate
Fe-gluconate, Fe(C_6H_11O_7_2xH_2O is a well-known material widely used for iron supplementation. On the other hand, it is used in food industry as a coloring agent, in cosmetic industry for skin and nail conditioning and metallurgy. Despite of wide range of applications its physical properties were not studied extensively. In this study, Fe-gluconate with three different amount of water viz. x=2 (fully hydrated, 0 < x < 2 (intermediate) and x=0 (dry) was investigated by means of X-ray diffraction (XRD) and M\"ossbauer spectroscopic (MS) methods. The former in the temperature range of 20-300 K, and the latter at 295 K. Based on the XRD measurements crystallographic structures were determined: monoclinic (space group I2) for the hydrated sample and triclinic (space group P1) for the dry sample. The partially hydrated sample was two-phased. Unit cells parameters for both structures show strong, very complex and non-monotonic temperature dependences. M\"ossbauer spectroscopic measurements gave evidence that iron in all samples exist in form of Fe(II) and Fe(III) ions. The amount of the latter equals to ca.30% in the hydrated sample and to ca.20% in the dry one.
2004.10535v3
2020-04-24
Magnetism driven by strong electronic correlation in the heavily carrier-doped iron oxypnictide LaFeAsO$_{0.49}$H$_{0.51}$
The magnetism of the second antiferromagnetic phase (AF2) arising in the iron-based LaFeAsO$_{1-x}$H$_{x}$ superconductor for $x\gtrsim0.4$ was investigated by muon spin rotation measurements under hydrostatic pressure up to 2.6 GPa. The N\'eel temperature ($T_{\rm N}$) obtained for a sample with $x=0.51$ exhibits considerably greater sensitivity to pressure than that in the pristine antiferromagnetic phase (AF1, $x\lesssim0.06$). Moreover, while the AF1 phase is always accompanied by the structural transition (from tetragonal to orthorhombic) at a temperature ($T_{\rm s}$) which is slightly higher than $T_{\rm N}$, the AF2 phase prevails at higher pressures above $\sim$1.5 GPa where the structural transition is suppressed ($T_{\rm s}=0$). These features indicate that the microscopic origin of the AF2 phase is distinct from that of AF1, suggesting that electronic correlation plays important role in the former phase. We argue that the orbital-selective Mott transition is a plausible scenario to account for the observed pressure dependence of $T_{\rm N}$ and $T_{\rm s}$ in the AF2 phase.
2004.11547v2
2020-05-16
Vacancy-driven non-cubic local structure and magnetic anisotropy tailoring in Fe$_x$O-Fe$_{3-δ}$O$_4$ nanocrystals
In contrast to bulk materials, nanoscale crystal growth is critically influenced by size- and shape-dependent properties. However, it is challenging to decipher how stoichiometry, in the realm of mixed-valence elements, can act to control physical properties, especially when complex bonding is implicated by short and long-range ordering of structural defects. Here, solution-grown iron-oxide nanocrystals (NCs) of the pilot wustite system are found to convert into iron-deficient rock-salt and ferro-spinel sub-domains, but attain a surprising tetragonally distorted local structure. Cationic vacancies within chemically uniform NCs are portrayed as the parameter to tweak the underlying properties. These lattice imperfections are shown to produce local exchange-anisotropy fields that reinforce the nanoparticles magnetization and overcome the influence of finite-size effects. The concept of atomic-scale defect control in subcritical size NCs, aspires to become a pathway to tailor-made properties with improved performance for hyperthermia heating over defect-free NCs.
2005.07947v1
2020-05-28
Rocklines as Cradles for Refractory Solids in the Protosolar Nebula
In our solar system, terrestrial planets and meteoritical matter exhibit various bulk compositions. To understand this variety of compositions, formation mechanisms of meteorites are usually investigated via a thermodynamic approach that neglect the processes of transport throughout the protosolar nebula. Here, we investigate the role played by rocklines (condensation/sublimation lines of refractory materials) in the innermost regions of the protosolar nebula to compute the composition of particles migrating inward the disk as a function of time. To do so, we utilize a one-dimensional accretion disk model with a prescription for dust and vapor transport, sublimation and recondensation of refractory materials (ferrosilite, enstatite, fayalite, forsterite, iron sulfide, metal iron and nickel). We find that the diversity of the bulk composition of cosmic spherules, chondrules and chondrites can be explained by their formation close to rocklines, suggesting that solid matter is concentrated in the vicinity of these sublimation/condensation fronts. Although our model relies a lot on the number of considered species and the availability of thermodynamic data governing state changes, it suggests that rocklines played a major role in the formation of small and large bodies in the innermost regions of the protosolar nebula. Our model gives insights on the mechanisms that might have contributed to the formation of Mercury's large core.
2005.14116v3
2020-06-12
SDSS J124043.01+671034.68: The partially burned remnant of a low-mass white dwarf that underwent thermonuclear ignition?
The white dwarf SDSS J124043.01+671034.68 (SDSS J1240+6710) was previously found to have an oxygen-dominated atmosphere with significant traces of neon, magnesium, and silicon. A possible origin via a violent late thermal pulse or binary interactions have been suggested to explain this very unusual photospheric composition. We report the additional detection of carbon, sodium, and aluminium in far-ultraviolet and optical follow-up spectroscopy. No iron-group elements are detected, with tight upper limits on iron, cobalt and nickel, suggesting that the star underwent partial oxygen burning, but failed to ignite silicon burning. Modelling the spectral energy distribution and adopting the distance based on the Gaia parallax, we infer a low white dwarf mass, M(wd)=0.41+/-0.05Msun. The large space velocity of SDSS J1240+6710, computed from the Gaia proper motion and its radial velocity, is compatible with a Galactic rest-frame velocity of ~250km/s in the opposite direction with respect to the Galactic rotation, strongly supporting a binary origin of this star. We discuss the properties of SDSS J1240+6710 in the context of the recently identified survivors of thermonuclear supernovae, the D6 and LP 40-365 stars, and conclude that it is unlikely related to either of those two groups. We tentatively suggest that SDSS J1240+6710 is the partially burned remnant of a low-mass white dwarf that underwent a thermonuclear event.
2006.07381v1
2020-06-15
Opacity Driven Convection and Variability in Accretion Disks around Supermassive Black Holes
We study the structure of accretion disks around supermassive black holes in the radial range $30\sim 100$ gravitational radii, using a three dimensional radiation magneto-hydrodynamic simulation. For typical conditions in this region of Active Galactic Nuclei (AGN), the Rosseland mean opacity is expected to be larger than the electron scattering value. We show that the iron opacity bump causes the disk to be convective unstable. Turbulence generated by convection puffs up the disk due to additional turbulent pressure support and enhances the local angular momentum transport. This also results in strong fluctuations in surface density and heating of the disk. The opacity drops with increasing temperature and convection is suppressed. The disk cools down and the whole process repeats again. This causes strong oscillations of the disk scale height and luminosity variations by more than a factor of $\approx 3-6$ over a few years' timescale. Since the iron opacity bump will move to different locations of the disk for black holes with different masses and accretion rates, we suggest that this is a physical mechanism that can explain the variability of AGN with a wide range of amplitudes over a time scale of years to decades.
2006.08657v1
2020-07-05
Size and temperature dependent magnetization of iron nanoclusters
The magnetic behavior of bcc iron nanoclusters, with diameters between 2 and 8 nm, is investigated by means of spin dynamics (SD) simulations coupled to molecular dynamics (MD-SD), using a distance-dependent exchange interaction. Finite-size effects in the total magnetization as well as the influence of the free surface and the surface/core proportion of the nanoclusters are analyzed in detail for a wide temperature range, going beyond the cluster and bulk Curie temperatures. Comparison is made with experimental data and with theoretical models based on the mean-field Ising model adapted to small clusters, and taking into account the influence of low coordinated spins at free surfaces. Our results for the temperature dependence of the average magnetization per atom M(T), including the thermalization of the transnational lattice degrees of freedom, are in very good agreement with available experimental measurements on small Fe nanoclusters. In contrast, significant discrepancies with experiment are observed if the translational degrees of freedom are artificially frozen. The finite-size effects on M(T) are found to be particularly important near the cluster Curie temperature. Simulated magnetization above the Curie temperature scales with cluster size as predicted by models assuming short-range magnetic ordering (SRMO). Analytical approximations to the magnetization as a function of temperature and size are proposed.
2007.02230v2
2020-07-06
On the Remarkable Superconductivity of FeSe and its Close Cousins
Emergent electronic phenomena in iron-based superconductors have been at the forefront of condensed matter physics for more than a decade. Much has been learned about the origin and intertwined roles of ordered phases, including nematicity, magnetism, and superconductivity, in this fascinating class of materials. In recent years, focus has been centered on the peculiar and highly unusual properties of FeSe and its close cousins. This family of materials has attracted considerable attention due to the discovery of unexpected superconducting gap structures, a wide range of superconducting critical temperatures, and evidence for nontrivial band topology, including associated spin-helical surface states and vortex-induced Majorana bound states. Here, we review superconductivity in iron chalcogenide superconductors, including bulk FeSe, doped bulk FeSe, FeTe$_{1-x}$Se$_x$, intercalated FeSe materials, and monolayer FeSe and FeTe$_{1-x}$Se$_x$ on SrTiO$_3$. We focus on the superconducting properties, including a survey of the relevant experimental studies, and a discussion of the different proposed theoretical pairing scenarios. In the last part of the paper, we review the growing recent evidence for nontrivial topological effects in FeSe-related materials, focusing again on interesting implications for superconductivity.
2007.02966v2
2020-07-11
Site preference of Fe atoms in the olivine (Fe$_x$Mg$_{2-x}$)SiO$_4$ and its surface
Olivine is involved in many natural reactions and industrial reactions as a catalyst. The catalytic ability is highly possible rely on the Fe$^{2+}$ in olivine. We use density functional theory calculation and thermodynamics to investigate the site preference of Fe atom in olivine which composition from iron-rich to iron-poor and its surfaces. The Fe$^{2+}$ always shows its high spin (quintet) state which has larger ion radius than Mg$^{2+}$ in olivine crystal and surfaces. The Fe$^{2+}$ inside the surface slab prefers the smaller M1 site than M2 site by enlarging the metal-oxygen octahedra when occupied the metal site as in the bulk system. Energy contribution of entropies accumulation caused temperature raise stops this preference at the temperature where a cation order-disorder distribution energy crossover happen in olivine. Surface exposed site provide Fe$^{2+}$ large space due its unsaturated nature. This lead a higher level of preference of Fe$^{2+}$ to the surface site than any metal site inside the crystal no matter M1 or M2 site is exposed. This indicate the Fe$^{2+}$ in the bulk system can diffuse to a metal site exposed on the surface driven by the energy difference. Many reactions can use the on surface Fe$^{2+}$ as a catalyst because of the active chemical behavior of Fe. Meanwhile this energetics preference should be considered in the future model to explain the natural observed zoning olivine have a high Fe edge and low Fe center. These microscopic understanding can be essential to many olivine related geochemical and astrochemical reactions.
2007.05851v3
2020-07-19
A geometric approach to separate the effects of magnetic susceptibility and chemical shift/exchange in a phantom with isotropic magnetic susceptibility
Purpose: To separate the effects of magnetic susceptibility and chemical shift/exchange in a phantom with isotropic magnetic susceptibility. To generate a chemical shift/exchange-corrected quantitative susceptibility mapping (QSM) result. Theory and Methods: Magnetic susceptibility and chemical shift/exchange are the properties of a material. Both are known to induce the resonance frequency shift in MRI. In current QSM, the susceptibility is reconstructed from the frequency shift, ignoring the contribution of the chemical shift/exchange. In this work, a simple geometric approach, which averages the frequency shift maps from three orthogonal B0 directions to generate a chemical shift/exchange map, is developed using the fact that the average nullifies the (isotropic) susceptibility effects. The resulting chemical shift/exchange map is subtracted from the total frequency shift, producing a frequency shift map solely from susceptibility. Finally, this frequency shift map is reconstructed to a susceptibility map using a QSM algorithm. The proposed method is validated in numerical simulations and applied to phantom experiments with olive oil, bovine serum albumin, ferritin, and iron oxide solutions. Results: Both simulations and experiments confirm that the method successfully separates the contributions of the susceptibility and chemical shift/exchange, reporting the susceptibility and chemical shift/exchange of olive oil (susceptibility: 0.62 ppm, chemical shift: -3.60 ppm), bovine serum albumin (susceptibility: -0.059 ppm, chemical shift: 0.008 ppm), ferritin (susceptibility: 0.125 ppm, chemical shift: -0.005 ppm), and iron oxide (susceptibility: 0.30 ppm, chemical shift: -0.039 ppm) solutions. Conclusion: The proposed method successfully separates the susceptibility and chemical shift/exchange in phantoms with isotropic magnetic susceptibility.
2007.09614v1
2020-07-21
Interplay of itinerant magnetism and reentrant spin-glass behavior in Fe$_{x}$Cr$_{1-x}$
When suppressing the itinerant antiferromagnetism in chromium by doping with the isostructual itinerant ferromagnet iron, a dome of spin-glass behavior emerges around a putative quantum critical point at an iron concentration $x \approx 0.15$. Here, we report a comprehensive investigation of polycrystalline samples of Fe$_{x}$Cr$_{1-x}$ in the range $0.05 \leq x \leq 0.30$ using x-ray powder diffraction, magnetization, ac susceptibility, and neutron depolarization measurements, complemented by specific heat and electrical resistivity data for $x = 0.15$. Besides antiferromagnetic ($x < 0.15$) and ferromagnetic regimes ($0.15 \leq x$), we identify a dome of reentrant spin-glass behavior at low temperatures for $0.10 \leq x \leq 0.25$ that is preceded by a precursor phenomenon. Neutron depolarization indicates an increase of the size of ferromagnetic clusters with increasing $x$ and the Mydosh parameter $\phi$, inferred from the ac susceptibility, implies a crossover from cluster-glass to superparamagnetic behavior. Taken together, these findings consistently identify Fe$_{x}$Cr$_{1-x}$ as an itinerant-electron system that permits to study the evolution of spin-glass behavior of gradually varying character in unchanged crystalline environment.
2007.10644v1
2021-02-03
Stellar astrophysics in the near UV with VLT-CUBES
Alongside future observations with the new European Extremely Large Telescope (ELT), optimised instruments on the 8-10m generation of telescopes will still be competitive at 'ground UV' wavelengths (3000-4000 A). The near UV provides a wealth of unique information on the nucleosynthesis of iron-peak elements, molecules, and neutron-capture elements. In the context of development of the near-UV CUBES spectrograph for ESO's Very Large Telescope (VLT), we are investigating the impact of spectral resolution on the ability to estimate chemical abundances for beryllium and more than 30 iron-peak and heavy elements. From work ahead of the Phase A conceptual design of CUBES, here we present a comparison of the elements observable at the notional resolving power of CUBES (R~20,000) to those with VLT-UVES (R~40,000). For most of the considered lines signal-to-noise is a more critical factor than resolution. We summarise the elements accessible with CUBES, several of which (e.g. Be, Ge, Hf) are now the focus of quantitative simulations as part of the ongoing Phase A study.
2102.02205v1
2021-02-07
Crystal structure and properties of iron-based spin-chain compound Ba9Fe3Se15
We report the synthesis of a new quasi one-dimensional (1D) iron selenide. Ba9Fe3Se15 was synthesized at high temperature and high pressure of 5.5 GPa and systematically studied via structural, magnetic and transport measurements at ambient and at high-pressures. Ba9Fe3Se15 crystallizes in a monoclinic structure and consists of face-sharing FeSe6 octahedral chains along the c axis. At ambient pressure it exhibits an insulating behavior with a band gap ~460 meV and undergoes a ferrimagnet-like phase transition at 14 K. Under high pressure, a complete metallization occurs at ~29 GPa, which is accompanied by a spin state crossover from high spin (HS) state to low spin (LS) state. The LS appears for pressures P >36 GPa.
2102.03708v1
2021-02-07
The phonon mechanism explanation of the superconductivity dichotomy between FeSe and FeS monolayers on STO and other substrates
It was observed recently (K. Shigekawa et al, PNAS 116, 2470 (2019)) that while monolayer iron chalcigenide FeSe on SrTiO3 (STO) substrate has a very high critical temperature, its chemical and structural "twin" material FeS=STO has a very low Tc if any. To explain this the substrate interfacial phonon model of superconductivity in iron chalcogenides is further developed. The main glue is the oxygen ion (60mev) vibrations longitudinal optical (LO) mode. The mode propagates mainly in the TiO2 layer adjacent to the monolayer (and genrally present also in similar highly polarized ionic crystals like BaTiO3; rutile, anatase). It has stronger electron - phonon coupling to electron gas in FeSe than a well known (100mev) harder LO mode. It is shown that while (taking into account screened Coulomb repulsion efects) the critical temperature of FeSe on STO and TiO2 is above 65K, it becomes less than 5K for FeS due to two factors suppressing the electron - phonon coupling. The efective mass in the later is twice smaller and in addition the distance between the electron gas in FeSe to the vibrating substrate oxygen atoms is 15% smaller than in FeS reducinng the central peak in electron-phonon interaction. The theory is extended to other ionic insulating substrates.
2102.03854v1
2021-02-09
Testing a Prototype 1U CubeSat on a Stratospheric Balloon Flight
High-altitude balloon experiments are becoming very popular among universities and research institutes as they can be used for testing instruments eventually intended for space, and for simple astronomical observations of Solar System objects like the Moon, comets, and asteroids, difficult to observe from the ground due to atmosphere. Further, they are one of the best platforms for atmospheric studies. In this experiment, we build a simple 1U CubeSat and, by flying it on a high-altitude balloon to an altitude of about 30 km, where the total payload weighted 4.9 kg and examine how some parameters, such as magnetic field, humidity, temperature or pressure, vary as a function of altitude. We also calibrate the magnetometer to remove the hard iron and soft iron errors. Such experiments and studies through a stratospheric balloon flights can also be used to study the performance of easily available commercial sensors in extreme conditions as well. We present the results of the first flight, which helped us study the functionality of the various sensors and electronics at low temperatures reaching about -40 degrees Celsius. Further the motion of the payload has been tracked throughout this flight. This experiment took place on 8 March 2020 from the CREST campus of the Indian Institute of Astrophysics, Bangalore. Using the results from this flight, we identify and rectify the errors to obtain better results from the subsequent flights.
2102.04847v1
2021-02-21
Meteoritic Proteins with Glycine, Iron and Lithium
We report that polymer amide [1] with a protein backbone of mainly glycine units and iron is present in the CV3 meteorites Acfer 086, Allende and KABA. The evidence for this is from particles of these meteorites after Folch extraction being analyzed by MALDI mass spectrometry and from the 3D physical structures that form in the various Folch solvent phases. The two physical forms we observe are branching rods and entrapping spheres on the 100micron scale. Two potential molecular structures of polymer amide are presented in this report. One we term hemolithin of mass 2320Da, contains glycine, hydroxy-glycine, Fe, O and Li. The other, we term hemoglycin of mass 1494Da is of glycine, hydroxy-glycine, Fe and O. Hemoglycin is connected covalently in triplets by silicon to form a triskelion. Analysis of the complete spectrum of isotopes associated with each molecular fragment shows very high 2H enhancement above terrestrial averaging 25,700 parts per thousand (sigma = 3,500, n=15), confirming extra-terrestrial origin and hence the existence of these molecules within the asteroid parent body of the CV3 meteorite class. The hemoglycin triskelia join via silicon bonds into an extended lattice, as seen in mass spectrometry of lattice fragments at m/z 4641 and above [2]. The identification of hemolithin and hemoglycin required careful methodology at room temperature with the minimum of steps up to mass spectrometry analysis ensuring that only the laser step fragmented the molecules. The 3D structures were imaged through permanently closed Folch extraction V-vials at a magnification of 10.
2102.10700v1
2021-02-22
Estimating SARS-CoV-2 Infections from Deaths, Confirmed Cases, Tests, and Random Surveys
There are many sources of data giving information about the number of SARS-CoV-2 infections in the population, but all have major drawbacks, including biases and delayed reporting. For example, the number of confirmed cases largely underestimates the number of infections, deaths lag infections substantially, while test positivity rates tend to greatly overestimate prevalence. Representative random prevalence surveys, the only putatively unbiased source, are sparse in time and space, and the results come with a big delay. Reliable estimates of population prevalence are necessary for understanding the spread of the virus and the effects of mitigation strategies. We develop a simple Bayesian framework to estimate viral prevalence by combining the main available data sources. It is based on a discrete-time SIR model with time-varying reproductive parameter. Our model includes likelihood components that incorporate data of deaths due to the virus, confirmed cases, and the number of tests administered on each day. We anchor our inference with data from random sample testing surveys in Indiana and Ohio. We use the results from these two states to calibrate the model on positive test counts and proceed to estimate the infection fatality rate and the number of new infections on each day in each state in the USA. We estimate the extent to which reported COVID cases have underestimated true infection counts, which was large, especially in the first months of the pandemic. We explore the implications of our results for progress towards herd immunity.
2102.10741v1
2021-06-03
Ultrafast demagnetization of iron induced by optical vs terahertz pulses
We study ultrafast magnetization quenching of ferromagnetic iron following excitation by an optical vs a terahertz pump pulse. While the optical pump (photon energy of 3.1 eV) induces a strongly nonthermal electron distribution, terahertz excitation (~4 meV) results in a quasi-thermal perturbation of the electron population. The pump-induced spin and electron dynamics are interrogated by the magneto-optic Kerr effect (MOKE). A deconvolution procedure allows us to push the time resolution down to 130 fs, even though the driving terahertz pulse is more than 0.5 ps long. Remarkably, the MOKE signals exhibit an almost identical time evolution for both optical and terahertz pump pulses, despite the three orders of magnitude different number of excited electrons. We are able to quantitatively explain our results using a model based on quasi-elastic spin-flip scattering. It shows that in the small-perturbation limit, the rate of demagnetization of a metallic ferromagnet is proportional to the excess energy of the electrons, independent of the precise shape of their distribution. Our results reveal that the dynamics of ultrafast demagnetization and of the closely related terahertz spin transport do not depend on the pump photon energy.
2106.01967v1
2021-06-14
Spin-pure Stochastic-CASSCF via GUGA-FCIQMC applied to Iron Sulfur Clusters
In this work we demonstrate how to compute the one- and two-body reduced density matrices within the spin-adapted full configuration interaction quantum Monte Carlo (FCIQMC) method, which is based on the graphical unitary group approach (GUGA). This allows us to use GUGA-FCIQMC as a spin-pure configuration interaction (CI) eigensolver within the complete active space self-consistent field (CASSCF) procedure, and hence to stochastically treat active spaces far larger than conventional CI solvers whilst variationally relaxing orbitals for specific spin-pure states. We apply the method to investigate the spin-ladder in iron-sulfur dimer and tetramer model systems. We demonstrate the importance of the orbital relaxation by comparing the Heisenberg model magnetic coupling parameters from the CASSCF procedure to those from a CI-only procedure based on restricted open-shell Hartree-Fock orbitals. We show that orbital relaxation differentially stabilizes the lower spin states, thus enlarging the coupling parameters with respect to the values predicted by ignoring orbital relaxation effects. Moreover, we find that while CI eigenvalues are well fit by a simple bilinear Heisenberg Hamiltonian, the CASSCF eigenvalues exhibits deviations that necessitate the inclusion of biquadratic terms in the model Hamiltonian.
2106.07775v1
2021-06-22
A two-stage robust optimization approach for oxygen flexible distribution under uncertainty in iron and steel plants
Oxygen optimal distribution is one of the most important energy management problems in the modern iron and steel industry. Normally, the supply of the energy generation system is determined by the energy demand of manufacturing processes. However, the balance between supply and demand fluctuates frequently due to the uncertainty arising in manufacturing processes. In this paper, we developed an oxygen optimal distribution model considering uncertain demands and proposed a two-stage robust optimization (TSRO) with a budget-based uncertainty set that protects the initial distribution decisions with low conservatism. The main goal of the TSRO model is to make wait-and-see decisions maximizing production profits and make here-and-now decisions minimizing operational stability and surplus/shortage penalty. To represent the uncertainty set of energy demands, we developed a Gaussian process (GP)-based time series model to forecast the energy demands of continuous processes and a capacity-constrained scheduling model to generate multi-scenario energy demands of discrete processes. We carried out extensive computational studies on TSRO and its components using well-synthetic instances from historical data. The results of model validation and analysis are promising and demonstrate our approach is adapted to solve industrial cases under uncertainty.
2106.11635v1
2021-06-23
Correlation Between Spin and Orbital Dynamics During Laser-Induced Femtosecond Demagnetization
Spin and orbital angular momenta are two intrinsic properties of an electron and are responsible for the physics of a solid. How the spin and orbital evolve with respect to each other on several hundred femtoseconds is largely unknown, but it is at the center of laser-induced ultrafast demagnetization. In this paper, we introduce a concept of the spin-orbital correlation diagram, where spin angular momentum is plotted against orbital angular momentum, much like the position-velocity phase diagram in classical mechanics. We use four sets of highly accurate time-resolved x-ray magnetic circular dichroism (TR-XMCD) data to construct four correlation diagrams for iron and cobalt. To our surprise, a pattern emerges. The trace on the correlation diagram for iron is an arc, and at the end of demagnetization, it has a pronounced cusp. The correlation diagram for cobalt is different and appears more linear, but with kinks. We carry out first-principles calculations with two different methods: time-dependent density functional theory (TDDFT) and time-dependent Liouville density functional theory (TDLDFT). These two methods agree that the experimental findings for both Fe and Co are not due t experimental errors. It is the spin-orbit coupling that correlates the spin dynamics to the orbital dynamics.Microscopically, Fe and Co have different orbital occupations, which leads to distinctive correlation diagrams. We believe that this correlation diagram presents a useful tool to better understand spin and orbital dynamics on an ultrafast time scale. A brief discussion on the magnetic anisotropy energy is also provided.
2106.12679v1
2021-07-09
Rapid interrogation of special nuclear materials by combining scattering and transmission nuclear resonance fluorescence spectroscopy
The smuggling of special nuclear materials (SNMs) across national borders is becoming a serious threat to nuclear nonproliferation. This paper presents a feasibility study on the rapid interrogation of concealed SNMs by combining scattering and transmission nuclear resonance fluorescence (sNRF and tNRF) spectroscopy. In sNRF spectroscopy, SNMs such as $^{235, 238}$U are excited by a wide-band photon beam of appropriate energy and exhibit unique NRF signatures. Monte Carlo simulations show that one-dimensional scans can realize isotopic identification of concealed $^{235, 238}$U when the detector array used for interrogation has sufficiently high energy resolution. The simulated isotopic ratio $^{235}U/^{238}U$ is in good agreement with the theoretical value when the SNMs are enclosed in relatively thin iron. This interrogation is followed by tNRF spectroscopy using a narrow-band photon beam with the goal of obtaining tomographic images of the concealed SNMs. The reconstructed image clearly reveals the position of the isotope $^{235}$U inside an iron rod. It is shown that the interrogation time of sNRF and tNRF spectroscopy is one order of magnitude lower than that when only tNRF spectroscopy is used and results in a missed-detection rate of 10$^{-3}$. The proposed method can also be applied for isotopic imaging of other SNMs such as $^{239, 240}$Pu and $^{237}$Np.
2107.04379v1
2021-11-01
Spectrum evolution and chirping of laser-induced spin wave packets in thin iron films
We present the experimental study of ultrafast optical excitation of magnetostatic surface spin wave (MSSW) packets and their spectral properties in thin films of pure iron. As the packets leave the excitation area and propagate in space, their spectra evolve non-trivially. Particularly, low or high frequency components are suppressed at the border of the excitation area depending on the orientation of the external magnetic field with respect to the magnetocrystolline anisotropy axes of the film. The effect is ascribed to the ultrafast local heating of the film. Further, the time resolution of the implemented all-optical technique allows us to extract the chirp of the MSSW packet in the time domain via wavelet analysis. The chirp is a result of the group velocity dispersion of the MSSW and, thus, is controlled by the film magnetic parameters, magnetization and anisotropy, and external field orientation. The demonstrated tunable modulation of MSSW wave packets with femtosecond laser pulses may find application in future magnonic-photonic hybrid devices for wave-based data processing.
2111.00983v2
2021-11-08
Microstructure, grain boundary evolution and anisotropic Fe segregation in (0001) textured Ti thin films
The structure and chemistry of grain boundaries (GBs) are crucial in determining polycrystalline materials' properties. Faceting and solute segregation to minimize the GB energy is a commonly observed phenomenon. In this paper, a deposition process to obtain pure tilt GBs in titanium (Ti) thin films is presented. By increasing the power density, a transition from polycrystalline film growth to a maze bicrystalline Ti film on SrTiO$_3$ (001) substrate is triggered. All the GBs in the bicrystalline thin film are characterized to be $\Sigma$13 [0001] coincident site lattice (CSL) boundaries. The GB planes are seen to distinctly facet into symmetric {$\bar{7}520$} and asymmetric {$10\bar{1}0$} // {$11\bar{2}0$} segments of 20-50~nm length. Additionally, EDS reveals preferential segregation of iron (Fe) in every alternate symmetric {$\bar{7}520$} segment. Both the faceting and the segregation are explained by a difference in the CSL density between the facet planes. Furthermore, in the GB plane containing Fe segregation, atom probe tomography is used to experimentally determine the GB excess solute to be 1.25~atoms/nm$^{2}$. In summary, the study reveals for the first time a methodology to obtain bicrystalline Ti thin films with strong faceting and anisotropy in iron (Fe) segregation behaviour within the same family of planes.
2111.04606v1
2021-11-08
The MOBH35 metal-organic barrier heights reconsidered: performance of local-orbital coupled cluster approaches in different static correlation regimes
We have revisited the MOBH35 (Metal-Organic Barrier Heights, 35 reactions) benchmark [Iron, M. A.; Janes, T. J. Phys. Chem. A 2019, 123 (17), 3761-3781; ibid. 2019, 123, 6379-6380] for realistic organometallic catalytic reactions, using both canonical CCSD(T) and localized orbital approximations to it. For low levels of static correlation, all of DLPNO-CCSD(T), PNO-LCCSD(T), and LNO-CCSD(T) perform well; for moderately strong levels of static correlation, DLPNO-CCSD(T) and (T1) may break down catastrophically, and PNO-LCCSD(T) is vulnerable as well. In contrast, LNO-CCSD(T) converges smoothly to the canonical CCSD(T) answer with increasingly tight convergence settings. The only two reactions for which our revised MOBH35 reference values differ substantially from the original ones are reaction 9 and to a lesser extent 8, both involving iron. For the purpose of evaluating DFT methods for MOBH35, it would be best to excise reaction 9 entirely as its severe level of static correlation is just too demanding a test. The magnitude of the difference between DLPNO-CCSD(T) and DLPNO-CCSD(T1) is a reasonably good predictor for errors in DLPNO-CCSD(T1) compared to canonical CCSD(T); [...]
2111.04777v3
2021-11-24
Metallicity of the globular cluster NGC 6388 from high resolution spectra of more than 160 giant stars
NGC 6388 is one of the most massive Galactic globular clusters (GC) and it is an old, metal-rich, Galactic bulge cluster. By exploiting previous spectroscopic observations we were able to bypass the uncertainties in membership related to the strong field stars contamination. We present the abundance analysis of 12 new giant stars with UVES spectra and 150 giants with GIRAFFE spectra acquired at the ESO-VLT. We derived radial velocities, atmospheric parameters and iron abundances for all stars. When combined to previous data, we obtain a grand total of 185 stars homogeneously analysed in NGC 6388 from high-resolution spectroscopy. The average radial velocity of the 185 stars is 81.2+/-0.7, rms = 9.4 km/s. We obtain an average metallicity [Fe/H]=-0.480 dex, rms = 0.045 dex (35 stars) and [Fe/H]=-0.488 dex, rms = 0.040 dex (150 stars) from the UVES and GIRAFFE samples, respectively. Comparing these values to internal errors in abundance, we exclude the presence of a significant intrinsic metallicity spread within the cluster. Since about a third of giants in NGC 6388 is claimed to belong to the "anomalous red giants" in the HST pseudo-colour map defining the so-called type-II GCs, we conclude that either enhanced metallicity is not a necessary requisite to explain this classification (as also suggested by the null iron spread for NGC 362) or NGC 6388 is not a type-II globular cluster.
2111.12721v1
2022-06-30
SRG/eROSITA discovery of a radio faint X-ray candidate supernova remnant SRGe J003602.3+605421=G121.1-1.9
We report the discovery of a candidate X-ray supernova remnant SRGe J003602.3+605421=G121.1-1.9 in the course of \textit{SRG}/eROSITA all-sky survey. The object is located at (l,b)=(121.1$^\circ$,-1.9$^\circ$), is $\approx36$ arcmin in angular size and has a nearly circular shape. Clear variations in spectral shape of the X-ray emission across the object are detected, with the emission from the inner (within 9') and outer (9'-18') parts dominated by iron and oxygen/neon lines, respectively. The non-equilibrium plasma emission model is capable of describing the spectrum of the outer part with the initial gas temperature 0.1 keV, final temperature 0.5 keV and the ionization age $\sim 2\times10^{10}$ cm$^{-3}$ s. The observed spectrum of the inner region is more complicated (plausibly due to the contribution of the outer shell) and requires substantial overabundance of iron for all models we have tried. The derived X-ray absorption equals to $(4-6)\times10^{21}$ cm$^{-2}$, locating the object at the distance beyond 1.5 kpc, and implying its age $\sim(5-30)\times1000$ yrs. No bright radio, infrared, H$_\alpha$ or gamma-ray counterpart of this object have been found in the publicly-available archival data. A model invoking a canonical $10^{51}$ erg explosion (either SN Ia or core collapse) in the hot and tenuous medium in the outer region of the Galaxy $\sim$9 kpc away might explain the bulk of the observed features. This scenario can be tested with future deep X-ray and radio observations.
2207.00064v2
2022-07-20
Dislocation Majorana Bound States in Iron-based Superconductors
We show that lattice dislocations of topological iron-based superconductors such as FeTe$_{1-x}$Se$_x$ will intrinsically trap non-Abelian Majorana quasiparticles, in the absence of any external magnetic field. Our theory is motivated by the recent experimental observations of normal-state topology and surface magnetism that coexist with superconductivity in FeTe$_{1-x}$Se$_x$, the combination of which naturally evokes an emergent second-order topological superconductivity in a two-dimensional subsystem spanned by screw or edge dislocations. This exemplifies a new embedded higher-order topological phase in class D, where Majorana zero modes appear around the "corners" of a low-dimensional embedded subsystem, instead of those of the full crystal. A nested domain wall theory is developed to understand the origin of these defect Majorana zero modes. When the surface magnetism is absent, we further find that $s_{\pm}$ pairing symmetry itself is capable of inducing a different type of class-DIII embedded higher-order topology with defect-bound Majorana Kramers pairs. We also provide detailed discussions on the real-world material candidates for our proposals, including FeTe$_{1-x}$Se$_x$, LiFeAs, $\beta$-PdBi$_2$, and heterostructures of bismuth, etc. Our work establishes lattice defects as a new venue to achieve high-temperature topological quantum information processing.
2207.10113v2
2017-04-18
Structure, magnetic susceptibility and specific heat of the spin-orbital-liquid candidate FeSc2S4 : Influence of fe off-stoichiometry
We report structural, susceptibility and specific heat studies of stoichiometric and off-stoichiometric poly- and single crystals of the A-site spinel compound FeSc2S4. In stoichiometric samples no long-range magnetic order is found down to 1.8 K. The magnetic susceptibility of these samples is field independent in the temperature range 10 - 400 K and does not show irreversible effects at low temperatures. In contrast, the magnetic susceptibility of samples with iron excess shows substantial field dependence at high temperatures and manifests a pronounced magnetic irreversibility at low temperatures with a difference between ZFC and FC susceptibilities and a maximum at 10 K reminiscent of a magnetic transition. Single crystal x-ray diffraction of the stoichiometric samples revealed a single phase spinel structure without site inversion. In single crystalline samples with Fe excess besides the main spinel phase a second ordered single-crystal phase was detected with the diffraction pattern of a vacancy-ordered superstructure of iron sulfide, close to the 5C polytype Fe9S10. Specific heat studies reveal a broad anomaly, which evolves below 20 K in both stoichiometric and off-stoichiometric crystals. We show that the low-temperature specific heat can be well described by considering the low-lying spin-orbital electronic levels of Fe2+ ions. Our results demonstrate significant influence of excess Fe ions on intrinsic magnetic behavior of FeSc2S4 and provide support for the spin-orbital liquid scenario proposed in earlier studies for the stoichiometric compound.
1704.05275v1
2017-04-20
Experimental Demonstration of the Sign Reversal of the Order Parameter in (Li1-xFex)OHFe1-yZnySe
Iron pnictides are the only known family of unconventional high-temperature superconductors besides cuprates. Until recently, it was widely accepted that superconductivity is spin-fluctuation driven and intimately related to their fermiology, specifically, hole and electron pockets separated by the same wave vector that characterizes the dominant spin fluctuations, and supporting order parameters (OP) of opposite signs. This picture was questioned after the discovery of a new family, based on the FeSe layers, either intercalated or in the monolayer form. The critical temperatures there reach ~40 K, the same as in optimally doped bulk FeSe - despite the fact that intercalation removes the hole pockets from the Fermi level and, seemingly, undermines the basis for the spin-fluctuation theory and the idea of a sign-changing OP. In this paper, using the recently proposed phase-sensitive quasiparticle interference technique, we show that in LiOH intercalated FeSe compound the OP does change sign, albeit within the electronic pockets, and not between the hole and electron ones. This result unifies the pairing mechanism of iron based superconductors with or without the hole Fermi pockets and supports the conclusion that spin fluctuations play the key role in electron pairing.
1704.06141v1
2017-04-25
Role of multiorbital effects in the magnetic phase diagram of iron-pnictides
We elucidate the pivotal role of the bandstructure's orbital content in deciding the type of commensurate magnetic order stabilized within the itinerant scenario of iron-pnictides. Recent experimental findings in the tetragonal magnetic phase attest to the existence of the so-called charge and spin ordered density wave over the spin-vortex crystal phase, the latter of which tends to be favored in simplified band models of itinerant magnetism. Here we show that employing a multiorbital itinerant Landau approach based on realistic bandstructures can account for the experimentally observed magnetic phase, and thus shed light on the importance of the orbital content in deciding the magnetic order. In addition, we remark that the presence of a hole pocket centered at the Brillouin zone's ${\rm M}$-point favors a magnetic stripe rather than a tetragonal magnetic phase. For inferring the symmetry properties of the different magnetic phases, we formulate our theory in terms of magnetic order parameters transforming according to irreducible representations of the ensuing D$_{\rm 4h}$ point group. The latter method not only provides transparent understanding of the symmetry breaking schemes but also reveals that the leading instabilities always belong to the $\{A_{1g},B_{1g}\}$ subset of irreducible representations, independent of their C$_2$ or C$_4$ nature.
1704.07862v2
2017-05-18
Effects of the Functional Group on the Lithium Ions Across the Port of Carbon Nanotube
The mean axial velocity of lithium irons across the entrance of carbon nanotube VLi is an important factor for the charge-discharge performances of rechargeable Lithium battery. The molecular dynamics simulation method is adopted to evaluate the factors and their effects on VLi which include the diameter of carbon nanotube, functional group type on the port and the number of a given type of functional group. The statistical analysis of the calculation results shows that: In the selected carbon nanotubes of four different diameters, VLi will gradually rise with the increase of CNT diameter due to lithium irons migration resistance decreasing; as the port of CNT is successively modified to hydrogen (-H), hydroxyl (-OH), amino (-NH2) and carboxyl (-COOH), the corresponding migration resistance of lithium ions is enhanced resulting in the dropping of VLi; in comparison to the effect strength of four types of functional groups on VLi, -COOH shows strongest, -NH2 and -OH perform relatively weaker, and the effect difference between -NH2 and -OH is very small, -H displays weakest; When the number of a given non-hydrogen functional group on the port sequentially increases, it also shows a trend that lithium ion migration resistance gradually increases which makes VLi decreases in turn. The more influential the functional group, the greater the impact of functional group number changes on VLi. The results of this paper have some significance on the precise production of lithium-ion battery electrode materials, enhancing the overall battery cycle efficiency and charging speed.
1705.06650v1
2017-05-27
High transport current superconductivity in powder-in-tube Ba0.6K0.4Fe2As2 tapes at 27 tesla
The high upper critical field and low anisotropy of iron-based superconductors make them being particularly attractive for high-field applications. However, the current carrying capability needs to be enhanced by overcoming the weak-link effect between misaligned grains inside wire and tape conductors. Here we demonstrate a high transport critical current density (Jc) reaching 1.5x10^5 A/cm^2 (Ic = 437 A) at 4.2 K and 10 T in Ba0.6K0.4Fe2As2 (Ba-122) tapes prepared by a combination of conventional powder-in-tube method and optimized hot-press technique. The transport Jc measured at 4.2 K under high magnetic fields of 27 T is still on the level of 5.5x10^4 A/cm^2, which is much higher than those of low-temperature superconductors. This is the first report of hot-pressed Ba-122 superconducting tapes and these Jc values are by far the highest ever reported for iron-based superconducting wires and tapes. These high-performance tapes exhibit high degree of c-axis texture of Ba-122 grains and low anisotropy of transport Jc, showing great potential for construction of high-field superconducting magnets.
1705.09788v1
2017-05-29
Critical Slowing Down of Quadrupole and Hexadecapole Orderings in Iron Pnictide Superconductor
Ultrasonic measurements have been carried out to investigate the critical dynamics of structural and superconducting transitions due to degenerate orbital bands in iron pnictide compounds with the formula Ba(Fe$_{1-x}$Co$_x$)$_2$As$_2$. The attenuation coefficient $\alpha_{\mathrm{L}[110]}$ of the longitudinal ultrasonic wave for $(C_{11}+C_{12}+2C_{66})/2$ for $x = 0.036$ reveals the critical slowing down of the relaxation time around the structural transition at $T_\mathrm{s} = 65$ K, which is caused by ferro-type ordering of the quadrupole $O_{x'^2-y'^2}$ coupled to the strain $\varepsilon_{xy}$. The attenuation coefficient $\alpha_{66}$ of the transverse ultrasonic wave for $C_{66}$ for $x = 0.071$ also exhibits the critical slowing down around the superconducting transition at $T_\mathrm{SC} = 23$ K, which is caused by ferro-type ordering of the hexadecapole $H_z^\alpha \bigl( \boldsymbol{r}_i, \boldsymbol{r}_j \bigr) = O_{x'y'}\bigl( \boldsymbol{r}_i \bigr) O_{x'^2 - y'^2}\bigl( \boldsymbol{r}_j \bigr) + O_{x'^2 - y'^2}\bigl( \boldsymbol{r}_i \bigr) O_{x'y'}\bigl( \boldsymbol{r}_j \bigr)$ of the bound two-electron state coupled to the rotation $\omega_{xy}$. It is proposed that the hexadecapole ordering associated with the superconductivity brings about spontaneous rotation of the macroscopic superconducting state with respect to the host tetragonal lattice.
1705.10057v1
2017-05-31
Terahertz spin currents and inverse spin Hall effect in thin-film heterostructures containing complex magnetic compounds
Terahertz emission spectroscopy of ultrathin multilayers of magnetic and heavy metals has recently attracted much interest. This method not only provides fundamental insights into photoinduced spin transport and spin-orbit interaction at highest frequencies but has also paved the way to applications such as efficient and ultrabroadband emitters of terahertz electromagnetic radiation. So far, predominantly standard ferromagnetic materials have been exploited. Here, by introducing a suitable figure of merit, we systematically compare the strength of terahertz emission from X/Pt bilayers with X being a complex ferro-, ferri- and antiferromagnetic metal, that is, dysprosium cobalt (DyCo$_5$), gadolinium iron (Gd$_{24}$Fe$_{76}$), Magnetite (Fe$_3$O$_4$) and iron rhodium (FeRh). We find that the performance in terms of spin-current generation not only depends on the spin polarization of the magnet's conduction electrons but also on the specific interface conditions, thereby suggesting terahertz emission spectroscopy to be a highly surface-sensitive technique. In general, our results are relevant for all applications that rely on the optical generation of ultrafast spin currents in spintronic metallic multilayers.
1705.11069v2
2017-06-02
Quenching current by flux-flow instability in iron-chalcogenides thin films
The stability against quench is one of the main issue to be pursued in a superconducting material which should be able to perform at very high levels of current densities. Here we focus on the connection between the critical current $I_c$ and the quenching current $I^*$ associated to the so-called flux-flow instability phenomenon, which sets in as an abrupt transition from the flux flow state to the normal state. To this purpose, we analyze several current-voltage characteristics of three types of iron-based thin films, acquired at different temperature and applied magnetic field values. For these samples, we discuss the impact of a possible coexistence of intrinsic electronic mechanisms and extrinsic thermal effects on the quenching current dependence upon the applied magnetic field. The differences between the quenching current and the critical current are reported also in the case of predominant intrinsic mechanisms. Carrying out a comparison with high-temperature cuprate superconductors, we suggest which material can be the best trade-off between maximum operating temperature, higher upper critical field and stability under high current bias.
1706.00772v1
2017-06-19
Evidence for Majorana bound state in an iron-based superconductor
The search for Majorana bound state (MBS) has recently emerged as one of the most active research areas in condensed matter physics, fueled by the prospect of using its non-Abelian statistics for robust quantum computation. A highly sought-after platform for MBS is two-dimensional topological superconductors, where MBS is predicted to exist as a zero-energy mode in the core of a vortex. A clear observation of MBS, however, is often hindered by the presence of additional low-lying bound states inside the vortex core. By using scanning tunneling microscope on the newly discovered superconducting Dirac surface state of iron-based superconductor FeTe1-xSex (x = 0.45, superconducting transition temperature Tc = 14.5 K), we clearly observe a sharp and non-split zero-bias peak inside a vortex core. Systematic studies of its evolution under different magnetic fields, temperatures, and tunneling barriers strongly suggest that this is the case of tunneling to a nearly pure MBS, separated from non-topological bound states which is moved away from the zero energy due to the high ratio between the superconducting gap and the Fermi energy in this material. This observation offers a new, robust platform for realizing and manipulating MBSs at a relatively high temperature.
1706.06074v3
2017-06-25
Frustration-driven C4 symmetric orders in a hetero-structured iron-based superconductor
A subtle balance between competing interactions in strongly correlated systems can be easily tipped by additional interfacial interactions in a heterostructure. This often induces exotic phases with unprecedented properties, as recently exemplified by high-Tc superconductivity in FeSe monolayer on the nonmagnetic SrTiO3. When the proximity-coupled layer is magnetically active, even richer phase diagrams are expected in iron-based superconductors (FeSCs), which however has not been explored due to the lack of a proper material system. One promising candidate is Sr2VO3FeAs, a naturally-assembled heterostructure of a FeSC and a Mott-insulating vanadium oxide. Here, using high-quality single crystals and high-accuracy 75As and 51V nuclear magnetic resonance (NMR) measurements, we show that a novel electronic phase is emerging in the FeAs layer below T0 ~ 155 K without either static magnetism or a crystal symmetry change, which has never been observed in other FeSCs. We find that frustration of the otherwise dominant Fe stripe and V Neel fluctuations via interfacial coupling induces a charge/orbital order with C4-symmetry in the FeAs layers, while suppressing the Neel antiferromagnetism in the SrVO3 layers. These findings demonstrate that the magnetic proximity coupling is effective to stabilize a hidden order in FeSCs and, more generally, in strongly correlated heterostructures.
1706.08157v1
2017-06-27
Magnetic fluctuations and superconducting properties of CaKFe4As4 studied by 75As NMR
We report $^{75}$As nuclear magnetic resonance (NMR) studies on a new iron-based superconductor CaKFe$_4$As$_4$ with $T_{\rm c}$ = 35 K. $^{75}$As NMR spectra show two distinct lines corresponding to the As(1) and As(2) sites close to the K and Ca layers, respectively, revealing that K and Ca layers are well ordered without site inversions. We found that nuclear quadrupole frequencies $\nu_{\rm Q}$ of the As(1) and As(2) sites show an opposite temperature ($T$) dependence. Nearly $T$ independent behavior of the Knight shifts $K$ are observed in the normal state, and a sudden decrease in $K$ in the superconducting (SC) state clearly evidences spin-singlet Cooper pairs. $^{75}$As spin-lattice relaxation rates 1/$T_1$ show a power law $T$ dependence with different exponents for the two As sites. The isotropic antiferromagnetic spin fluctuations characterized by the wavevector ${\bf q}$ = ($\pi$, 0) or (0, $\pi$) in the single-iron Brillouin zone notation are revealed by 1/$T_1T$ and $K$ measurements. Such magnetic fluctuations are necessary to explain the observed temperature dependence of the $^{75}$As quadrupole frequencies, as evidenced by our first-principles calculations. In the SC state, 1/$T_1$ shows a rapid decrease below $T_{\rm c}$ without a Hebel-Slichter peak and decreases exponentially at low $T$, consistent with an $s^{\pm}$ nodeless two-gap superconductor.
1706.09075v2
2018-02-05
Discrete superconducting phases in FeSe-derived superconductors
A general feature of unconventional superconductors is the existence of a superconducting dome in the phase diagram as a function of carrier concentration. For the simplest iron-based superconductor FeSe (with transition temperature Tc ~ 8 K), its Tc can be greatly enhanced by doping electrons via many routes, even up to 65 K in monolayer FeSe/SiTiO3. However, a clear phase diagram with carrier concentration for FeSe-derived superconductors is still lacking. Here, we report the observation of a series of discrete superconducting phases in FeSe thin flakes by continuously tuning carrier concentration through the intercalation of Li and Na ions with a solid ionic gating technique. Such discrete superconducting phases are robust against the substitution of Se by 20% S, but are vulnerable to the substitution of Fe by 2% Cu, highlighting the importance of the iron site being intact. A complete superconducting phase diagram for FeSe-derivatives is given, which is distinct from other unconventional superconductors.
1802.01484v1
2018-02-06
Imaging Orbital-selective Quasiparticles in the Hund's Metal State of FeSe
Strong electronic correlations, emerging from the parent Mott insulator phase, are key to copper-based high temperature superconductivity (HTS). By contrast, the parent phase of iron-based HTS is never a correlated insulator. But this distinction may be deceptive because Fe has five active d-orbitals while Cu has only one. In theory, such orbital multiplicity can generate a Hund's Metal state, in which alignment of the Fe spins suppresses inter-orbital fluctuations producing orbitally selective strong correlations. The spectral weights $Z_m$ of quasiparticles associated with different Fe orbitals m should then be radically different. Here we use quasiparticle scattering interference resolved by orbital content to explore these predictions in FeSe. Signatures of strong, orbitally selective differences of quasiparticle $Z_m$ appear on all detectable bands over a wide energy range. Further, the quasiparticle interference amplitudes reveal that $Z_{xy}<Z_{xz}<<Z_{yz}$, consistent with earlier orbital-selective Cooper pairing studies. Thus, orbital-selective strong correlations dominate the parent state of iron-based HTS in FeSe.
1802.02266v2
2018-02-20
Monte-Carlo simulations of the detailed iron absorption line profiles from thermal winds in X-ray binaries
Blue shifted absorption lines from highly ionised iron are seen in some high inclination X-ray binary systems, indicating the presence of an equatorial disc wind. This launch mechanism is under debate, but thermal driving should be ubiquitous. X-ray irradiation from the central source heats disc surface, forming a wind from the outer disc where the local escape velocity is lower than the sound speed. The mass loss rate from each part of the disc is determined by the luminosity and spectral shape of the central source. We use these together with an assumed density and velocity structure of the wind to predict the column density and ionisation state, then combine this with a Monte Carlo radiation transfer to predict the detailed shape of the absorption (and emission) line profiles. We test this on the persistent wind seen in the bright neutron star binary GX 13+1, with luminosity L/LEdd ~ 0.5. We approximately include the effect of radiation pressure because of high luminosity, and compute line features. We compare these to the highest resolution data, the Chandra third order grating spectra, which we show here for the first time. This is the first physical model for the wind in this system, and it succeeds in reproducing many of the features seen in the data, showing that the wind in GX13+1 is most likely a thermal-radiation driven wind. This approach, combined with better streamline structures derived from full radiation hydrodynamic simulations, will allow future calorimeter data to explore the detail wind structure.
1802.07019v1
2018-07-04
Doping effects of Cr on the physical properties of BaFe$_{1.9-x}$Ni$_{0.1}$Cr$_{x}$As$_{2}$
We present a systematic study on the heavily Cr doped iron pnictides BaFe$_{1.9-x}$Ni$_{0.1}$Cr$_{x}$As$_{2}$ by using elastic neutron scattering, high-resolution synchrotron X-ray diffraction (XRD), resistivity and Hall transport measurements. When the Cr concentration increases from $x=$ 0 to 0.8, neutron diffraction experiments suggest that the collinear antiferromagnetism persists in the whole doping range, where the N\'{e}el temperature $T_N$ coincides with the tetragonal-to-orthorhombic structural transition temperature $T_s$, and both of them keeps around 35 K. The magnetic ordered moment, on the other hand, increases within increasing $x$ until $x=$ 0.5, and then decreases with further increasing $x$. Detailed refinement of the powder XRD patterns reveals that the Cr substitutions actually stretch the FeAs$_4$ tetrahedron along the $c-$axis and lift the arsenic height away Fe-Fe plane. Transport results indicate that the charge carriers become more localized upon Cr doping, then changes from electron-type to hole-type around $x=$ 0.5. Our results suggest that the ordered moment and the ordered temperature of static magnetism in iron pnictides can be decoupled and tuned separately by chemical doping.
1807.01612v1
2018-07-17
Chemical Compositions of Field and Globular Cluster RR Lyrae Stars: I. NGC 3201
We present a detailed spectroscopic analysis of horizontal branch stars in the globular cluster NGC 3201. We collected optical (4580-5330 A), high resolution (~34,000), high signal-to-noise ratio (~200) spectra for eleven RR Lyrae stars and one red horizontal branch star with the multifiber spectrograph M2FS at the 6.5m Magellan telescope at the Las Campanas Observatory. From measured equivalent widths we derived atmospheric parameters and abundance ratios for {\alpha} (Mg, Ca, Ti), iron peak (Sc, Cr, Ni, Zn) and s-process (Y) elements. We found that NGC 3201 is a homogeneous, mono-metallic ([Fe/H]=-1.47 +- 0.04), {\alpha}-enhanced ([{\alpha}/Fe]=0.37 +- 0.04) cluster. The relative abundances of the iron peak and s-process elements were found to be consistent with solar values. In comparison with other large stellar samples, NGC 3201 RR Lyraes have similar chemical enrichment histories as do those of other old (t>10 Gyr) Halo components (globular clusters, red giants, blue and red horizontal branch stars, RR Lyraes). We also provided a new average radial velocity estimate for NGC 3201 by using a template velocity curve to overcome the limit of single epoch measurements of variable stars: Vrad=494 +- 2 km s-1({\sigma}=8 km s-1).
1807.06681v1
2018-07-27
Relativistic reflection from accretion disks in the population of Active Galactic Nuclei at z=0.5-4
We report the detection of relativistically broadened iron K alpha emission in the X-ray spectra of AGN detected in the 4Ms CDF-S. Using the Bayesian X-ray analysis (BXA) package, we fit 199 hard band (2-7 keV) selected sources in the redshift range z=0.5--4 with three models: (i) an absorbed power-law, (ii) the first model plus a narrow reflection component, and (iii) the second model with an additional relativistic broadened reflection. The Bayesian evidence for the full sample of sources selects the model with the additional broad component as being 10^5 times more probable to describe the data better than the second model. For the two brightest sources in our sample, CID 190 (z=0.734) and CID 104 (z=0.543), BXA reveals the relativistic signatures in the individual spectra. We estimate the fraction of sources containing a broad component to be 54^{+35}_{-37}% (107/199 sources). Considering that the low signal-to-noise ratio of some spectra prevents the detection of the broad iron K alpha line, we infer an intrinsic fraction with broad emission of around two thirds. The detection of relativistic signatures in the X-ray spectra of these sources suggests that they are powered by a radiatively efficient accretion disk. Preliminary evidence is found that the spin of the black hole is high, with a maximally spinning Kerr BH model (a=1) providing a significantly better fit than a Schwarzschild model (a=0). Our analysis demonstrate the potential of X-ray spectroscopy to measure this key parameter in typical SMBH systems at the peak of BH growth.
1807.10677v1
2018-08-10
Majority carrier type inversion in FeSe family and "doped semimetal" scheme in iron-based superconductors
The field and temperature dependencies of the longitudinal and Hall resistivity have been studied for high-quality FeSe${}_{1-x}$S${}_{x}$ (x up to 0.14) single crystals. Quasiclassical analysis of the obtained data indicates a strong variation of the electron and hole concentrations under the studied isovalent substitution and proximity of FeSe to the point of the majority carrier-type inversion. On this basis, we propose a `doped semimetal' scheme for the superconducting phase diagram of the FeSe family, which can be applied to other iron-based superconductors. In this scheme, the two local maxima of the superconducting temperature can be associated with the Van Hove singularities of a simplified semi-metallic electronic structure. The multicarrier analysis of the experimental data also reveals the presence of a tiny and highly mobile electron band for all the samples studied. Sulfur substitution in the studied range leads to a decrease in the number of mobile electrons by more than ten times, from about 3\% to about 0.2\%. This behavior may indicate a successive change of the Fermi level position relative to singular points of the electronic structure which is consistent with the `doped semimetal' scheme. The scattering time for mobile carriers does not depend on impurities, which allows us to consider this group as a possible source of unusual acoustic properties of FeSe.
1808.03551v2
2018-08-11
Physical conditions for the r-process I. radioactive energy sources of kilonovae
Radioactive energies from unstable nuclei made in the ejecta of neutron star mergers play principal roles in powering kilonovae. In previous studies power-law-type heating rates (e.g., ~ t^-1.3) have frequently been used, which may be inadequate if the ejecta are dominated by nuclei other than the A ~ 130 region. We consider, therefore, two reference abundance distributions that match the r-process residuals to the solar abundances for A >= 69 (light trans-iron plus r-process elements) and A >= 90 (r-process elements). Nucleosynthetic abundances are obtained by using free-expansion models with three parameters: expansion velocity, entropy, and electron fraction. Radioactive energies are calculated as an ensemble of weighted free-expansion models that reproduce the reference abundance patterns. The results are compared with the bolometric luminosity (> a few days since merger) of the kilonova associated with GW170817. We find that the former case (fitted for A >= 69) with an ejecta mass 0.06 M_sun reproduces the light curve remarkably well including its steepening at > 7 days, in which the mass of r-process elements is ~ 0.01 M_sun. Two beta-decay chains are identified: 66Ni -> 66Cu -> 66Zn and 72Zn -> 72Ga -> 72Ge with similar halflives of parent isotopes (~ 2 days), which leads to an exponential-like evolution of heating rates during 1-15 days. The light curve at late times (> 40 days) is consistent with additional contributions from the spontaneous fission of 254Cf and a few Fm isotopes. If this is the case, the event GW170817 is best explained by the production of both light trans-iron and r-process elements that originate from dynamical ejecta and subsequent disk outflows from the neutron star merger.
1808.03763v2
2018-08-15
c-axis pressure induced antiferromagnetic order in optimally P-doped BaFe2(As0.70P0.30)2 superconductor
Superconductivity in BaFe2(As1-xPx)2 iron pnictides emerges when its in-plane two-dimensional (2D) orthorhombic lattice distortion associated with nematic phase at Ts and three-dimensional (3D) collinear antiferromagnetic (AF) order at TN (Ts = TN) are gradually suppressed with increasing x, reaching optimal superconductivity around x = 0.30 with Tc $\approx$ 30 K. Here we show that a moderate uniaxial pressure along the c-axis in BaFe2(As0.70P0.30)2 spontaneously induces a 3D collinear AF order with TN = Ts > 30 K, while only slightly suppresses Tc. Although a ~ 400 MPa pressure compresses the c-axis lattice while expanding the in-plane lattice and increasing the nearest-neighbor Fe-Fe distance, it barely changes the average iron-pnictogen height in BaFe2(As0.70P0.30)2. Therefore, the pressure- induced AF order must arise from a strong in-plane magnetoelastic coupling, suggesting that the 2D nematic phase is a competing state with superconductivity.
1808.05153v1
2018-08-16
Relativistic Tidal Disruption and Nuclear Ignition of White Dwarf Stars by Intermediate Mass Black Holes
We present results from general relativistic calculations of the tidal disruption of white dwarf stars from near encounters with intermediate mass black holes. We follow the evolution of 0.2 and $0.6 M_\odot$ stars on parabolic trajectories that approach $10^3$ - $10^4 M_\odot$ black holes as close as a few Schwarzschild radii at periapsis, paying particular attention to the effect tidal disruption has on thermonuclear reactions and the synthesis of intermediate to heavy ion elements. These encounters create diverse thermonuclear environments characteristic of Type I supernovae and capable of producing both intermediate and heavy mass elements in arbitrary ratios, depending on the strength (or proximity) of the interaction. Nuclear ignition is triggered in all of our calculations, even at weak tidal strengths $\beta \sim 2.6$ and large periapsis radius $R_P \sim 28$ Schwarzschild radii. A strong inverse correlation exists between the mass ratio of calcium to iron group elements and tidal strength, with $\beta \lesssim 5$ producing predominately calcium-rich debris. At these moderate to weak interactions, nucleosynthesis is not especially efficient, limiting the total mass and outflows of calcium group elements to $< 15$\% of available nuclear fuel. Iron group elements however continue to be produced in greater quantity and ratio with increasing tidal strength, peaking at $\sim 60$\% mass conversion efficiency in our closest encounter cases. These events generate short bursts of gravitational waves with characteristic frequencies 0.1-0.7 Hz and strain amplitudes $0.5\times10^{-22}$ - $3.5\times10^{-22}$ at 10 Mpc source distance.
1808.05664v1
2018-08-18
Ultra-high critical current densities, the vortex phase diagram and the effect of granularity of the stoichiometric high-Tc superconductor, CaKFe$_4$As$_4$
We present a comprehensive study of the critical current densities and the superconducting vortex phase diagram in the stoichiometric superconductor CaKFe$_4$As$_4$ which has a critical temperature of 35 K. We performed detailed magnetization measurements both of high quality single crystals for different orientations in an applied magnetic field up to 16 T and for a powder sample. We find an extremely large critical current density, Jc, up to 10$^8$ A/cm2 for single crystals when H||(ab) at 5 K, which remains robust in fields up to 16 T, being the largest of any other iron-based superconductor. The critical current density is reduced by a factor 10 in single crystals when H||c at 5 K and significantly suppressed by the presence of grain boundaries in the powder sample. We also observe the presence of the fishtail effect in the magnetic hysteresis loops of single crystals when H||c. The flux pinning force density and the pinning parameters suggest that the large critical current could be linked to the existence of point core and surface pinning. Based on the vortex phase diagram and the large critical current densities, CaKFe$_4$As$_4$ is now established as a potential iron-based superconductor candidate for practical applications.
1808.06072v1
2018-08-19
Local Electronic Structure of Interstitial Hydrogen in Iron Disulfide
The electronic structure of interstitial hydrogen in a compound semiconductor FeS$_2$ (naturally $n$-type) is inferred from a muon study. An implanted muon (Mu, a pseudo-hydrogen) forms electronically different defect centers discerned by the hyperfine parameter ($\omega_{\rm hf}$). A body of evidence indicates that one muon is situated at the center of an iron-cornered tetrahedron with nearly isotropic $\omega_{\rm hf}$ (Mu$_{\rm p}$), and that the other exists as a diamagnetic state (Mu$_{\rm d}$, $\omega_{\rm hf}\simeq 0$). Their response to thermal agitation indicates that the Mu$_{\rm d}$ center accompanies a shallow level (donor or acceptor) understood by effective mass model while the electronic structure of Mu$_{\rm p}$ center is more isolated from host than Mu$_{\rm d}$ to form a deeper donor level. These observations suggest that interstitial hydrogen also serves as an electronically active impurity in FeS$_2$. Based on earlier reports on the hydrogen diffusion in FeS$_2$, possibility of fast diffusion for Mu$_{\rm p}$ leading to formation of a complex defect state (Mu$^*_{\rm d}$, $T\le 100$ K) or to motional narrowing state (Mu$^*_{\rm p}$, $T\ge 150$ K) is also discussed.
1808.06153v1
2018-08-23
Correlation between non-Fermi-liquid behavior and superconductivity in (Ca, La)(Fe,Co)As2 iron arsenides: A high-pressure study
Non-Fermi-liquid (NFL) phenomena associated with correlation effects have been widely observed in the phase diagrams of unconventional superconducting families. Exploration of the correlation between the normal state NFL, regardless of its microscopic origins, and the superconductivity has been argued as a key to unveiling the mystery of the high-Tc pairing mechanism. Here we systematically investigate the pressure-dependent in-plane resistivity and Hall coefficient (RH ) of a high-quality 112-type Fe-based superconductor Ca1-xLaxFe1-yCoyAs2 (x = 0.2,y = 0.02). With increasing pressure, the normal-state resistivity of the studied sample exhibits a pronounced crossover from non-Fermi-liquid to Fermi-liquid behaviors. Accompanied with this crossover, Tc is gradually suppressed. In parallel, the extremum in the Hall coefficient RH (T ) curve, possibly due to anisotropic scattering induced by spin fluctuations, is also gradually suppressed. The symbiosis of NFL and superconductivity implies that these two phenomena are intimately related. Further study on the pressure-dependent upper critical field reveals that the two-band effects are also gradually weakened with increasing pressure and reduced to the one-band Werthamer-Helfand-Hohenberg limit in the low-Tc regime. Overall, our paper supports the picture that NFL, multigap, and extreme RH (T ) are all of the same magnetic origin, i.e., the spin fluctuations in the 112 iron arsenide superconductors.
1808.07609v1
2018-08-26
Intertwined Spin and Orbital Density Waves in MnP Uncovered by Resonant Soft X-ray Scattering
Unconventional superconductors are often characterized by numerous competing and even intertwined orders in their phase diagrams. In particular, the electronic nematic phases, which spontaneously break rotational symmetry and often simultaneously involve spin, charge and/or orbital orders, appear conspicuously in both the cuprate and iron-based superconductors. The fluctuations associated with these phases may provide the exotic pairing glue that underlies their high-temperature superconductivity. Helimagnet MnP, the first Mn-based superconductor under pressure, lacks high rotational symmetry. However our resonant soft X-ray scattering (RSXS) experiment discovers novel helical orbital density wave (ODW) orders in this three-dimensional, low-symmetry system, and reveals intertwined ordering phenomena in unprecedented detail. In particular, a ODW forms with half the period of the spin order and fully develops slightly above the spin ordering temperature, their domains develop simultaneously, yet the spin order domains are larger than those of the ODW, and they cooperatively produce another ODW with 1/3 the period of the spin order. These observations provide a comprehensive picture of the intricate interplay between spin and orbital orders in correlated materials, and they suggest that nematic-like physics ubiquitously exists beyond two-dimensional and high-symmetry systems, and the superconducting mechanism of MnP is likely analogous to those of cuprate and iron-based superconductors.
1808.08562v1
2018-10-18
Human-sized Magnetic Particle Imaging for Brain Applications
Determining the brain perfusion is an important task for the diagnosis and treatment of vascular diseases such as occlusions and intracerebral haemorrhage. Even after successful diagnosis and treatment, there is a high risk of restenosis or rebleeding such that patients need intense and frequent attention in the days after treatment. Within this work, we will present a diagnostic tomographic imager that allows access to brain perfusion information quantitatively in short intervals. The imager is the first functional magnetic particle imaging device for brain imaging on a human-scale. It is highly sensitive and allows the detection of an iron concentration of 14.7 ng /ml (263 pmol\ml), which is the lowest iron concentration imaged by MPI so far. The imager is self-shielded and can be used in unshielded environments such as intensive care units. In combination with the low technical requirements this opens up a whole variety of possible medical applications and would allow monitoring possibilities on the stroke and intensive care units.
1810.07987v1
2019-01-08
Observation of half-integer level shift of vortex bound states in an iron-based superconductor
Vortices in topological superconductors host Majorana zero modes (MZMs), which are proposed to be building blocks of fault-tolerant topological quantum computers. Recently, a new single-material platform for realizing MZM has been discovered in iron-based superconductors, without involving hybrid semiconductor-superconductor structures. Here we report on a detailed scanning tunneling spectroscopy study of a FeTe0.55Se0.45 single crystal, revealing two distinct classes of vortices present in this system which differ by a half-integer level shift in the energy spectra of the vortex bound states. This level shift is directly tied with the presence or absence of zero-bias peak and also alters the ratios of higher energy levels from integer to half-odd-integer. Our model calculations fully reproduce the spectra of these two types of vortex bound states, suggesting the presence of topological and conventional superconducting regions that coexist within the same crystal. Our findings provide strong evidence for the topological nature of superconductivity in FeTe0.55Se0.45 and establish it as an excellent platform for further studies on MZMs.
1901.02293v1
2019-01-19
Study of the X-ray properties of the neutron-star binary 4U 1728$-$34 from the soft to hard state
We studied five XMM-Newton observations of the neutron-star binary 4U 1728$-$34 covering the hard, intermediate and soft spectral states. By jointly fitting the spectra with several reflection models, we obtained an inclination angle of 25$-$53$\deg$ and an iron abundance up to 10 times the solar. From the fits with reflection models, we found that the fluxes of the reflection and the Comptonised components vary inconsistently; since the latter is assumed to be the illuminating source, this result possibly indicates the contribution of the neutron star surface/boundary layer to the disc reflection. As the source evolved from the relatively soft to the intermediate state, the disc inner radius decreased, opposite to the prediction of the standard accretion disc model. We also explore the possible reasons why the supersolar iron abundance is required by the data and found that this high value is probably caused by the absence of the hard photons in the XMM-Newton data.
1901.06473v1
2019-01-28
Super-Eddington accretion onto the Galactic ultraluminous X-ray pulsar Swift J0243.6+6124
We report on the spectral behavior of the first Galactic ultraluminous X-ray pulsar Swift J0243.6+6124 with NuSTAR observations during its 2017-2018 outburst. At sub-Eddington levels, the source spectrum is characterized by three emission components, respectively from the accretion column, the hot spot, and a broad iron line emission region. When the source is above the Eddington limit, the hot spot temperature increases and the spectrum features two more blackbody components. One blackbody component has a radius of 10-20 km and is likely originated from the top of the accretion column. The other one saturates at a blackbody luminosity of (1 - 2)*10^38 erg/s, coincident with the Eddington limit of a neutron star. This is well consistent with the scenario that super-Eddington accretion onto compact objects will power optically-thick outflows and indicates an accretion rate 60-80 times the critical value. This suggests that super-Eddington accretion onto magnetized systems can also power massive winds. At super-Eddington levels, the iron line becomes more significant and blueshifted, and is argued to be associated with the ultrafast wind in the central funnel or jets. This source, if located in external galaxies, will appear like other ultraluminous pulsars.
1901.09485v1
2019-04-01
A Chandra and ALMA Study of X-ray-irradiated Gas in the Central ~100 pc of the Circinus Galaxy
We report a study of X-ray-irradiated gas in the central ~100 pc of the Circinus galaxy, hosting a Compton-thick active galactic nucleus (AGN), at 10-pc resolution using Chandra and ALMA. Based on ~200 ksec Chandra/ACIS-S data, we created an image of the Fe Kalpha line at 6.4 keV, tracing X-ray-irradiated dense gas. The ALMA data in Bands 6 (~270 GHz) and 7 (~350 GHz) cover five molecular lines: CO(J=3--2), HCN(J=3--2), HCN(J=4--3), HCO^+(J=3--2), and HCO^+(J=4--3). The detailed spatial distribution of dense molecular gas was revealed, and compared to the iron line image. The molecular gas emission appeared faint in regions with bright iron emission. Motivated by this, we quantitatively discuss the possibility that the molecular gas is efficiently dissociated by AGN X-ray irradiation (i.e., creating an X-ray-dominated region). Based on a non-local thermodynamic equilibrium model, we constrained the molecular gas densities and found that they are as low as interpreted by X-ray dissociation. Furthermore, judging from inactive star formation (SF) reported in the literature, we suggest that the X-ray emission has potential to suppress SF, particularly in the proximity of the AGN.
1904.01144v1
2019-04-12
Nearly quantized conductance plateau of vortex zero mode in an iron-based superconductor
Majorana zero-modes (MZMs) are spatially-localized zero-energy fractional quasiparticles with non-Abelian braiding statistics that hold a great promise for topological quantum computing. Due to its particle-antiparticle equivalence, an MZM exhibits robust resonant Andreev reflection and 2e2/h quantized conductance at low temperature. By utilizing variable-tunnel-coupled scanning tunneling spectroscopy, we study tunneling conductance of vortex bound states on FeTe0.55Se0.45 superconductors. We report observations of conductance plateaus as a function of tunnel coupling for zero-energy vortex bound states with values close to or even reaching the 2e2/h quantum conductance. In contrast, no such plateau behaviors were observed on either finite energy Caroli-de Genne-Matricon bound states or in the continuum of electronic states outside the superconducting gap. This unique behavior of the zero-mode conductance reaching a plateau strongly supports the existence of MZMs in this iron-based superconductor, which serves as a promising single-material platform for Majorana braiding at a relatively high temperature.
1904.06124v2
2019-04-14
Impact of the first order antiferromagnetic phase transition on the paramagnetic spin excitations and nematic phase of SrFe$_2$As$_2$
Understanding the nature of the electronic nematic phase in iron pnictide superconductors is important for elucidating its impact on high-temperature superconductivity. Here we use transport and inelastic neutron scattering to study spin excitations and in-plane resistivity anisotropy in uniaxial pressure detwinned BaFe$_2$As$_2$ and SrFe$_2$As$_2$, the parent compounds of iron pnictide superconductors. While BaFe$_2$As$_2$ exhibits weakly first order tetragonal-to-orthorhombic structural and antiferromagnetic (AF) phase transitions below $T_s > T_N\approx 138$ K, SrFe$_2$As$_2$ has strongly coupled first order structural and AF transitions below $T_s= T_N\approx 210$ K. We find that the direct signatures of the nematic phase persist to lower temperatures above the phase transition in the case of SrFe$_2$As$_2$ compared to BaFe$_2$As$_2$. Our findings support the conclusion that the strongly first-order nature of the magnetic transition in SrFe$_2$As$_2$ weakens the nematic phase and resistivity anisotropy in the system.
1904.06743v1
2019-06-13
The influence of antiferromagnetism, soft out-of plane phonons and heavy electrons on the superconducting pairing mechanism of Ba1-xKxFe2As2
Based on ab-initio calculated parameters, we apply a theoretical model on the iron-based BaFe2As2 superconductor that takes into account dramatic enhancements of the electron-phonon coupling of soft transverse phonons in the FeAs layers and antiferromagnetism. Our model is able to reproduce the Tc values of BaFe2As2 found under pressure in experiments. To calculate the Tc of the K-doped Ba1-xKxFe2As2 system as a function of the K content, we additionally consider the experimentally observed effective mass enhancements and Kondo temperatures in the strongly over-doped region (0.8 < x < 1), which decouple the antiferromagnetism and electron-phonon scattering. The highest theoretical Tc at the optimal doping concentration is reproduced after optimization of antiferromagnetic fluctuations and electron-phonon coupling. Our model is also able to reproduce the dip-like structure in Tc in the region where a re-entrant tetragonal phase of C4 symmetry is found (0.24 < x < 0.28) and indicates the weakening effect of local exchange correlation energy as responsible for Tc reduction. Our model thus demonstrates that the high transition temperatures and the exact doping and pressure dependence of this iron-based superconductor can be explained within an extended electron-phonon coupling model in which the structural, magnetic and electronic degrees of freedom are strongly intertwined.
1906.05789v1
2019-06-24
Melting of vortex lattice in magnetic superconductor $\mathrm{Rb}\mathrm{Eu}\mathrm{Fe}_{4}\mathrm{As}_{4}$
The iron-based superconductors are characterized by strong fluctuations due to high transition temperatures and small coherence lengths. We investigate fluctuation behavior in the magnetic iron-pnictide superconductor $\mathrm{Rb}\mathrm{Eu}\mathrm{Fe}_{4}\mathrm{As}_{4}$ by calorimetry and transport. We find that the broadening of the specific-heat transition in magnetic fields is very well described by the lowest-Landau-level scaling. We report calorimetric and transport observations for vortex-lattice melting, which is seen as a sharp drop of the resistivity and a step of the specific heat at the magnetic-field-dependent temperature. The melting line in the temperature/magnetic-field plane lies noticeably below the upper-critical-field line and its location is in quantitative agreement with theoretical predictions without fitting parameters. Finally, we compare the melting behavior of $\mathrm{Rb}\mathrm{Eu}\mathrm{Fe}_{4}\mathrm{As}_{4}$ with other superconducting materials showing that thermal fluctuations of vortices are not as prevalent as in the high-temperature superconducting cuprates, yet they still noticeably influence the properties of the vortex matter.
1906.10236v2
2019-06-26
Near 100% CO Selectivity in Nanoscaled Iron-Based Oxygen Carriers for Chemical Looping Methane Partial Oxidation
Chemical looping methane partial oxidation provides an energy and cost effective route for methane utilization. However, there is considerable CO2 co-production in state-of-the-art chemical looping systems, rendering a decreased productivity in value-added fuels or chemicals. In this work, we show that the co-production of CO2 can be dramatically suppressed in methane partial oxidation reactions using iron oxide nanoparticles, with a size of 2~8 nm, as the oxygen carrier. To stabilize these nanoparticles at high temperatures, they are embedded in an ordered, gas-permeable mesoporous silica matrix. We experimentally obtained near 100% CO selectivity in a cyclic redox system at 750{\deg}C to 935{\deg}C, which is a significantly lower temperature range than in conventional oxygen carrier systems. Density functional theory calculations elucidate the origins for such selectivity and reveal that CH4 adsorption energies decrease with increasing nanoparticle size. These calculations also show that low-coordinated lattice oxygen atoms on the surface of nanoparticles significantly promote Fe-O bond cleavage and CO formation. We envision that embedded nanostructured oxygen carriers have the potential to serve as a general materials platform for achieving 100% selectivity in redox reactions at high temperatures.
1906.11160v1
2019-07-15
Stellar atmospheric parameters for 754 spectra from the X-shooter Spectral Library
The X-shooter Spectral Library (XSL) is an empirical stellar library at medium spectral resolution covering the wavelength range from 3000 \AA to 24 800 \AA. This library aims to provide a benchmark for stellar population studies. In this work, we present a uniform set of stellar atmospheric parameters, effective temperatures, surface gravities, and iron abundances for 754 spectra of 616 XSL stars. We used the full-spectrum fitting package ULySS with the empirical MILES library as reference to fit the ultraviolet-blue (UVB) and visible (VIS) spectra. We tested the internal consistency and we compared our results with compilations from the literature. The stars cover a range of effective temperature 2900 < Teff < 38 000 K, surface gravity 0 < log g < 5.7, and iron abundance -2.5 < [Fe/H] < +1.0, with a couple of stars extending down to [Fe/H] = -3.9. The precisions of the measurements for the G- and K-type stars are 0.9%, 0.14, and 0.06 in Teff, log g, and [Fe/H], respectively. For the cool giants with log g < 1, the precisions are 2.1%, 0.21, and 0.22, and for the other cool stars these values are 1%, 0.14, and 0.10. For the hotter stars (Teff > 6500 K), these values are 2.6%, 0.20, and 0.10 for the three parameters.
1907.06391v1
2019-07-15
Neutron powder diffraction study on the non-superconducting phases of ThFeAsN$_{1-x}$O$_x$ ($x=0.15, 0.6$) iron pnictide
We use neutron powder diffraction to study on the non-superconducting phases of ThFeAsN$_{1-x}$O$_x$ with $x=0.15, 0.6$. In our previous results on the superconducting phase ThFeAsN with $T_c=$ 30 K, no magnetic transition is observed by cooling down to 6 K, and possible oxygen occupancy at the nitrogen site is shown in the refinement(H. C. Mao \emph{et al.}, EPL, 117, 57005 (2017)). Here, in the oxygen doped system ThFeAsN$_{1-x}$O$_x$, two superconducting region ($0\leqslant x \leqslant 0.1$ and $0.25\leqslant x \leqslant 0.55$) have been identified by transport experiments (B. Z. Li \emph{et al.}, J. Phys.: Condens. Matter 30, 255602 (2018)). However, within the resolution of our neutron powder diffraction experiment, neither the intermediate doping $x=0.15$ nor the heavily overdoped compound $x= 0.6$ shows any magnetic order from 300 K to 4 K. Therefore, while it shares the common phenomenon of two superconducting domes as most of 1111-type iron-based superconductors, the magnetically ordered parent compound may not exist in this nitride family.
1907.06531v1
2019-07-17
Detailed spectroscopic and photometric study of three detached eclipsing binaries
Detached eclipsing binaries are remarkable systems to provide accurate fundamental stellar parameters. The fundamental stellar parameters and the metallicity values of stellar systems are needed to deeply understand the stellar evolution and formation. In this study, we focus on the detailed spectroscopic and photometric studies of three detached eclipsing binary systems, V372\,And, V2080\,Cyg, and CF\,Lyn to obtain their accurate stellar, atmospheric parameters,and chemical compositions. An analysis of light and radial velocity curves was carried out to derive the orbital and stellar parameters. The disentangled spectra of component stars were obtained for the spectroscopic analysis. Final \teff, \logg, $\xi$, \vsini\, parameters and the element abundances of component stars were derived by using the spectrum synthesis method. The fundamental stellar parameters were determined with a high certainty for V372\,And, V2080\,Cyg ($\sim$$1-2$\%) and with an accuracy for CF\,Lyn ($\sim$$2-6$\%). The evolutionary status of the systems was examined and their ages were obtained. It was found that the component stars of V2080\,Cyg have similar iron abundance which is slightly lower than solar iron abundance. Additionally, we showed that the primary component of CF\,Lyn exhibits a non-spherical shape with its 80\% Roche lobe filling factor. It could be estimated that CF\,Lyn will start its first Roche overflow in the next 0.02\,Gyr.
1907.07560v1
2019-07-29
Near-linear Scaling in DMRG-based Tailored Coupled Clusters: An Implementation of DLPNO-TCCSD and DLPNO-TCCSD(T)
We present a new implementation of DMRG-based tailored coupled clusters method (TCCSD), which employs the domain-based local pair natural orbital approach (DLPNO-TCCSD). Compared to the previous LPNO version of the method, the new implementation is more accurate, offers more favorable scaling and provides more consistent behavior across the variety of systems. On top of the singles and doubles, we include the perturbative triples correction (T), which is able to retrieve even more dynamic correlation. The methods were tested on three systems: tetramethyleneethane, oxo-Mn(Salen) and Iron(II)-porphyrin model. The first two were revisited to assess the performance with respect to LPNO-TCCSD. For oxo-Mn(Salen), we retrieved between 99.8-99.9% of the total canonical correlation energy which is the improvement of 0.2% over the LPNO version in less than 63% of the total LPNO runtime. Similar results were obtained for Iron(II)-porphyrin. When the perturbative triples correction was employed, irrespective of the active space size or system, the obtained energy differences between two spin states were within the chemical accuracy of 1 kcal/mol using the default DLPNO settings.
1907.13466v3
2019-10-02
Nuclear Ignition of White Dwarf Stars by Relativistic Encounters with Rotating Intermediate Mass Black Holes
We present results from general relativistic calculations of nuclear ignition in white dwarf stars triggered by near encounters with rotating intermediate mass black holes with different spin and alignment parameters. These encounters create thermonuclear environments characteristic of Type Ia supernovae capable of producing both calcium and iron group elements in arbitrary ratios, depending primarily on the proximity of the interaction which acts as a strong moderator of nucleosynthesis. We explore the effects of black hole spin and spin-orbital alignment on burn product synthesis to determine whether they might also be capable of moderating reactive flows. When normalized to equivalent impact penetration, accounting for frame dragging corrections, the influence of spin is weak, no more than 25% as measured by nuclear energy release and mass of burn products, even for near maximally rotating black holes. Stars on prograde trajectories approach closer to the black hole and produce significantly more unbound debris and iron group elements than is possible by encounters with nonrotating black holes or by retrograde orbits, at more than 50% mass conversion efficiency. The debris contains several radioisotopes, most notably Ni56, made in amounts that produce sub-luminous (but still observable) light curves compared to branch-normal SNe Ia.
1910.01054v1
2019-10-16
Controlling Ferromagnetic Ground States and Solitons in Thin Films and Nanowires built from Iron Phthalocyanine Chains
Iron phthalocyanine (FePc) is a molecular semiconductor whose building blocks are one-dimensional ferromagnetic chains. We show that its optical and magnetic properties are controlled by the growth strategy, obtaining extremely high coercivities of over 1 T and modulating the exchange constant between 15 and 29 K through tuning the crystal phase by switching from organic molecular beam deposition, producing continuous thin films of nanocrystals with controlled orientations, to organic vapour phase deposition, producing ultralong nanowires. Magnetisation measurements are analysed using a suite of concepts and simply stated formulas with broad applicability to all one-dimensional ferromagnetic chains. They show that FePc is best described by a Heisenberg model with a preference for the moments to lie in the molecular planes, where the chain Hamiltonian is very similar to that for the classic inorganic magnet CsNiF3, but with ferromagnetic rather than antiferromagnetic interchain interactions. The data at large magnetic fields are well-described by the soliton picture, where the dominant (and topologically non-trivial) degrees of freedom are moving one-dimensional magnetic domain walls, which was successful for CsNiF3, and at low temperatures and fields by the super-Curie-Weiss law of 1/(T^2+theta^2) characteristic of nearly one-dimensional xy and Heisenberg ferromagnets. The ability to control the molecular orientation and ferromagnetism of FePc systems, and produce them on flexible substrates as thin films or nanowires, taken together with excellent transistor characteristics reported previously for nanowires of copper and cobalt analogues, makes them potentially useful for magneto-optical and spintronic devices.
1910.07229v1
2019-10-18
An ionised accretion disc wind in Hercules X-1
Hercules X-1 is one of the best studied highly magnetised neutron star X-ray binaries with a wealth of archival data. We present the discovery of an ionised wind in its X-ray spectrum when the source is in the high state. The wind detection is statistically significant in most of the XMM-Newton observations, with velocities ranging from 200 to 1000 km/s. Observed features in the iron K band can be explained by both wind absorption or by a forest of iron emission lines. However, we also detect nitrogen, oxygen and neon absorption lines at the same systematic velocity in the high-resolution RGS grating spectra. The wind must be launched from the accretion disc, and could be the progenitor of the UV absorption features observed at comparable velocities, but the latter likely originate at significantly larger distances from the compact object. We find strong correlations between the ionisation level of the outflowing material and the ionising luminosity as well as the super-orbital phase. If the luminosity is driving the correlation, the wind could be launched by a combination of Compton heating and radiation pressure. If instead the super-orbital phase is the driver for the variations, the observations are likely scanning the wind at different heights above the warped accretion disc. If this is the case, we can estimate the wind mass outflow rate, corrected for the limited launching solid angle, to be roughly 70% of the mass accretion rate.
1910.08337v2
2019-10-20
PUSHing core-collapse supernovae to explosions in spherical symmetry IV: Explodability, remnant properties and nucleosynthesis yields of low metallicity stars
In this fourth paper of the series, we use the parametrized, spherically symmetric explosion method PUSH to perform a systematic study of two sets of non-rotating stellar progenitor models. Our study includes pre-explosion models with metallicities Z=0 and Z=Z$_{\odot}\times 10^{-4}$ and covers a progenitor mass range from 11 up to 75 M$_\odot$. We present and discuss the explosion properties of all models and predict remnant (neutron star or black hole) mass distributions within this approach. We also perform systematic nucleosynthesis studies and predict detailed isotopic yields as function of the progenitor mass and metallicity. We present a comparison of our nucleosynthesis results with observationally derived $^{56}$Ni ejecta from normal core-collapse supernovae and with iron-group abundances for metal-poor star HD~84937. Overall, our results for explosion energies, remnant mass distribution, $^{56}$Ni mass, and iron group yields are consistent with observations of normal CCSNe. We find that stellar progenitors at low and zero metallicity are more prone to BH formation than those at solar metallicity, which allows for the formation of BHs in the mass range observed by LIGO/VIRGO.
1910.08958v2
2019-12-08
The vertical Na-O relation in the bulge globular cluster NGC 6553
In this article, we present a detailed chemical analysis of seven red giant members of NGC 6553 using high-resolution spectroscopy from VLT FLAMES. We obtained the stellar parameters (Teff, Log(g), vt, [Fe/H]) of these stars from the spectra, and we measured the chemical abundance for 20 elements, including light elements, iron-peak elements, alpha-elements and neutron-capture elements. The metallicities in our sample stars are consistent with a homogeneous distribution. We found a mean of [Fe/H]=-0.14+/-0.07 dex, in agreement with other studies. Using the alpha-elements Mg, Si, Ca and Ti we obtain the mean of [alpha/Fe]=0.11+/-0.05. We found a vertical relation between Na and O, characterized by a significant spread in Na and an almost non-existent spread in O. In fact, Na and Al are the only two light elements with a large intrinsic spread, which demonstrates the presence of Multiple Populations (MPs). An intrinsic spread in Mg is not detected in this study. The alpha, iron-peak and neutron capture elements show good agreement with the trend of the bulge field stars, indicating similar origin and evolution, in concordance with our previous studies for two other bulge GCs (NGC 6440 and NGC 6528).
1912.03742v2
2019-12-10
Magnetic properties of thin epitaxial Pd$_{1-x}$Fe$_x$ alloy films
In the paper we present the results of extensive studies of palladium-rich Pd1-xFex alloy films epitaxially grown on MgO single-crystal substrate. In a composition range of x = 0.01-0.07 these materials are soft ferromagnets, the saturation magnetization and magnetic anisotropy of which can be tuned by its composition. Vibrating sample magnetometry was used to study temperature dependences of spontaneous magnetic moment and to establish the temperature of magnetic ordering (Curie temperature). Ferromagnetic resonance (FMR) measurements at low temperatures in the in-plane and out-of-plane geometries revealed the four-fold in-plane magnetic anisotropy with the easy directions along the <110> axes of the substrate. The modelling of the angular dependence of the field for resonance allowed to extract the cubic and tetragonal contributions to the magnetic anisotropy of the films and establish their dependence on the concentration of iron in the alloy. Experimental data are discussed in the framework of existing theories of dilute magnetic alloys. Using the anisotropy constants established from FMR, the magnetic hysteresis loops are reproduced utilizing the Stoner-Wohlfarth model thus indicating the predominant coherent magnetic moment rotation at low temperatures. The obtained results compile a database of magnetic properties of a palladium-iron alloy considered as a material for superconducting spintronics.
1912.04852v1
2019-12-16
High-Temperature Quantum Anomalous Hall Insulators in Lithium-Decorated Iron-Based Superconductor Materials
Quantum anomalous Hall (QAH) insulator is the key material to study emergent topological quantum effects, but its ultralow working temperature limits experiments. Here, by first-principles calculations, we find a family of stable two-dimensional (2D) structures generated by lithium decoration of layered iron-based superconductor materials FeX (X = S, Se, Te), and predict room-temperature ferromagnetic semiconductors together with large-gap high-Chern-number QAH insulators in the 2D materials. The extremely robust ferromagnetic order is induced by the electron injection from Li to Fe and stabilized by strong ferromagnetic kinetic exchange in the 2D Fe layer. While in the absence of spin-orbit coupling (SOC), the ferromagnetism polarizes the system into a half Dirac semimetal state protected by mirror symmetry, the SOC effect results in a spontaneous breaking of mirror symmetry and introduces a Dirac mass term, which creates QAH states with sizable gaps (several tens of meV) and multiple chiral edge modes. We also find a 3D QAH insulator phase featured by macroscopic number of chiral conduction channels in bulk LiOH-LiFeX. The findings open new opportunities to realize novel QAH physics and applications at high temperatures.
1912.07461v4
2020-03-06
Ab initio theory of graphene-iron(II) phthalocyanine hybrid systems as scalable molecular spintronics
Graphene - transition metal phthalocyanine (G-MPc) hybrid systems constitute promising platforms for densely-packed single-molecule magnets (SMMs). Here, we selected iron(II) phthalocyanine (FePc) and investigated its interaction with pristine and defective graphene layers employing density functional theory. Our calculations indicate that thorough proper dehydrogenation of the benzol rings in the FePc molecule its adsorption to graphene is thermodynamically favorable. In general, the presence of anchoring sites on the graphene layer, i.e. point defects, additionally facilitates the adsorption of FePc, allowing one to achieve high density of SMMs per unit area. Using the combination of group theory, ligand field splitting, and the calculated PBE0 Kohn-Sham eigenvalue spectrum, we resolved the electronic structure and predicted the spin states of both, the isolated FePc and G-FePc hybrid systems. Regardless of adsorption site and the number of removed hydrogen atoms from the benzol rings of FePc, the magnetic moment of the SMM remains unchanged with respect to free FePc. These results should mediate a successful synthesis of densely-packed G-MPc systems and may open up new avenue in designing scalable graphene - SMMs systems for spintronics applications.
2003.03189v1
2020-03-22
A statistical study of the plasma and composition distribution inside magnetic clouds: 1998-2011
A comprehensive analysis of plasma and composition characteristics inside magnetic clouds (MCs) observed by the Advanced Composition Explorer (ACE) spacecraft from 1998 February to 2011 August is presented. The results show that MCs have specific interior structures, and MCs of different speeds show differences in composition and structure. Compared with the slow MCs, fast MCs have enhanced mean charge states of iron, oxygen, silicon, magnesium, $\mathrm{O^{7+}/O^{6+}}$, $\mathrm{C^{6+}/C^{5+}}$, $\mathrm{C^{6+}/C^{4+}}$ and $\mathrm{Fe^{\geq16+}/Fe_{total}}$ values. For ionic species in fast MCs, a higher atomic number represents a greater enhancement of mean charge state than slow MCs. We also find that both the fast and slow MCs display bimodal structure distribution in the mean iron charge state ($\mathrm{\langle Q\rangle Fe}$), which suggests that the existence of flux rope prior to the eruption is common. Furthermore, the $\mathrm{\langle Q\rangle Fe} $, $\mathrm{Fe^{\geq16+}/Fe_{total}}$, and $\mathrm{O^{7+}/O^{6+}}$ ratio distribution inside fast MCs have the feature that the posterior peak is higher than the anterior one. This result agrees with the "standard model" for CME/flares, by which magnetic reconnection occurs beneath the flux rope, thereby ionizing the ions of the posterior part of flux rope sufficiently by high-energy electron collisions or by direct heating in the reconnection region.
2003.09965v1
2020-08-03
When superconductivity does not fear magnetism: Insight into electronic structure of RbEuFe$_{4}$As$_{4}$
In the novel stoichiometric iron-based material RbEuFe$_{4}$As$_{4}$ superconductivity coexists with a peculiar long-range magnetic order of Eu 4f states. Using angle-resolved photoemission spectroscopy, we reveal a complex three dimensional electronic structure and compare it with density functional theory calculations. Multiple superconducting gaps were measured on various sheets of the Fermi surface. High resolution resonant photoemission spectroscopy reveals magnetic order of the Eu 4f states deep into the superconducting phase. Both the absolute values and the anisotropy of the superconducting gaps are remarkably similar to the sibling compound without Eu, indicating that Eu magnetism does not affect the pairing of electrons. A complete decoupling between Fe- and Eu-derived states was established from their evolution with temperature, thus unambiguously demonstrating that superconducting and a long range magnetic orders exist independently from each other. The established electronic structure of RbEuFe$_{4}$As$_{4}$ opens opportunities for the future studies of the highly unorthodox electron pairing and phase competition in this family of iron-based superconductors with doping.
2008.00736v1
2020-08-10
On The Development of Multidimensional Progenitor Models For Core-collapse Supernovae
Multidimensional hydrodynamic simulations of shell convection in massive stars suggest the development of aspherical perturbations that may be amplified during iron core-collapse. These perturbations have a crucial and qualitative impact on the delayed neutrino-driven core-collapse supernova explosion mechanism by increasing the total stress behind the stalled shock. In this paper, we investigate the properties of a 15 \msun model evolved in 1-,2-, and 3-dimensions (3D) for the final $\sim$424 seconds before gravitational instability and iron core-collapse using MESA and the FLASH simulation framework. We find that just before collapse, our initially perturbed fully 3D model reaches angle-averaged convective velocity magnitudes of $\approx$ 240-260 km s$^{-1}$ in the Si- and O-shell regions with a Mach number $\approx$ 0.06. We find the bulk of the power in the O-shell resides at large scales, characterized by spherical harmonic orders ($\ell$) of 2-4, while the Si-shell shows broad spectra on smaller scales of $\ell\approx30-40$. Both convective regions show an increase in power at $\ell=5$ near collapse. We show that the 1D \texttt{MESA} model agrees with the convective velocity profile and speeds of the Si-shell when compared to our highest resolution 3D model. However, in the O-shell region, we find that \texttt{MESA} predicts speeds approximately \emph{four} times slower than all of our 3D models suggest. All eight of the multi-dimensional stellar models considered in this work are publicly available.
2008.04266v1
2020-08-31
Creep deformation of WC hardmetals with iron-based binders
Iron is a candidate to replace cobalt in WC hardmetals, due to its lower cost and toxicity. A WC-FeCr hardmetal was compression tested at 900-1200 {\deg}C. Particular attention is paid to the steady-state creep rates and stress-exponents (n) during isostress treatments. Three regimes of stress dependence are observed. Two of these were previously reported for WC-Co: power law creep (n~3) at medium stresses; and grain boundary sliding (n~1) at higher stresses, generally >100MPa. A previously unreported low stress (<10MPa) regime with an exponent of n~2 is also observed. By combining electron microscopy with X-ray diffraction texture measurements, the low stress regime is attributed to viscous flow of the binder, which is accommodated by diffusional creep in the WC skeleton. The mechanism may be applicable to other hardmetals. Compared to analogous WC-Co materials, WC-FeCr shows improved creep resistance below 1000 {\deg}C, which can be explained by its lower self-diffusivity, and a lower solubility for WC than Co. However, at temperatures corresponding to liquid eutectic formation (~1140 {\deg}C), its creep resistance becomes inferior. These results indicate FeCr may be a suitable replacement for Co provided the eutectic temperature is not exceeded.
2008.13565v1
2020-09-02
Multimodal assessment of nigrosomal degeneration in Parkinson's disease
Background: Approximately forty percent of all dopaminergic neurons in SNpc are located in five dense neuronal clusters, named nigrosomes. T2- or T2*-weighted images are used to delineate the largest nigrosome, named nigrosome-1. In these images, nigrosome-1 is a hyperintense region in the caudal and dorsal portion of the T2- or T2*-weighted substantia nigra. In PD, nigrosome-1 experiences iron accumulation, which leads to a reduction in T2-weighted hyperintensity. Here, we examine neuromelanin-depletion and iron deposition in regions of interest (ROIs) derived from quantitative-voxel based morphometry (qVBM) on neuromelanin-sensitive images and compare the ROIs with nigrosome-1 identified in T2*-weighted images. Methods: Neuromelanin-sensitive and multi-echo gradient echo imaging data were obtained. R2* was calculated from multi-echo gradient echo imaging data. qVBM analysis was performed on neuromelanin-sensitive images and restricted to SNpc. Mean neuromelanin-sensitive contrast and R2* was measured from the resulting qVBM clusters. Nigrosome-1 was segmented in T2*-weighted images of control subjects and its location was compared to the spatial location of the qVBM clusters. Results: Two bilateral clusters emerged from the qVBM analysis. These clusters showed reduced neuromelanin-sensitive contrast and increased mean R2* in PD as compared to controls. Cluster-1 from the qVBM analysis was in a similar spatial location as nigrosome-1, as seen in T2*-weighted images. Conclusion: qVBM cluster-1 shows reduced neuromelanin-sensitive contrast and is in a similar spatial position as nigrosome-1. This region likely corresponds to nigrosome-1 while the second cluster may correspond to nigrosome-2.
2009.01378v1
2020-09-09
Accretion disk's magnetic field controlled the composition of the terrestrial planets
Chondrites, the building blocks of the terrestrial planets, have mass and atomic proportions of oxygen, iron, magnesium, and silicon totaling $\geq$90\% and variable Mg/Si ($\sim$25\%), Fe/Si (factor of $\geq$2), and Fe/O (factor of $\geq$3). The Earth and terrestrial planets (Mercury, Venus, and Mars) are differentiated into three layers: a metallic core, a silicate shell (mantle and crust), and a volatile envelope of gases, ices, and, for the Earth, liquid water. Each layer has different dominant elements (e.g., increasing Fe content with depth and increasing oxygen content to the surface). What remains an unknown is to what degree did physical processes during nebular disk accretion versus those during post-nebular disk accretion (e.g., impact erosion) influence these final bulk compositions. Here we predict terrestrial planet compositions and show that their core mass fractions and uncompressed densities correlate with their heliocentric distance, and follow a simple model of the magnetic field strength in the protoplanetary disk. Our model assesses the distribution of iron in terms of increasing oxidation state, aerodynamics, and a decreasing magnetic field strength outward from the Sun, leading to decreasing core size of the terrestrial planets with radial distance. This distribution would enhance habitability in our solar system, and would be equally applicable to exo-planetary systems.
2009.04311v1
2020-09-11
Electronic nematic states tuned by isoelectronic substitution in bulk FeSe1-xSx
Isoelectronic substitution is an ideal tuning parameter to alter electronic states and correlations in iron-based superconductors. As this substitution takes place outside the conducting Fe planes, the electronic behaviour is less affected by the impurity scattering experimentally and relevant key electronic parameters can be accessed. In this short review, I present the experimental progress made in understanding the electronic behaviour of the nematic electronic superconductors, FeSe1-xSx. A direct signature of the nematic electronic state is in-plane anisotropic distortion of the Fermi surface triggered by orbital ordering effects and electronic interactions that result in multi-band shifts detected by ARPES. Upon sulphur substitution, the electronic correlations and the Fermi velocities decrease in the tetragonal phase. Quantum oscillations are observed for the whole series in ultra-high magnetic fields and show a complex spectra due to the presence of many small orbits. Effective masses associated to the largest orbit display non-divergent behaviour at the nematic end point (x~0.175(5)), as opposed to critical spin-fluctuations in other iron pnictides. Magnetotransport behaviour has a strong deviation from the Fermi liquid behaviour and linear T resistivity is detected at low temperatures inside the nematic phase, where scattering from low energy spin-fluctuations are likely to be present. The superconductivity is not enhanced in FeSe1-xSx and there are no divergent electronic correlations at the nematic end point. These manifestations indicate a strong coupling with the lattice in FeSe1-xSx and a pairing mechanism likely promoted by spin fluctuations.
2009.05523v1
2020-09-21
The Impact of Outflows driven by Active Galactic Nuclei on Metals in and around Galaxies
Metals in the hot gaseous halos of galaxies encode the history of star formation as well as the feedback processes that eject metals from the galaxies. X-ray observations suggest that massive galaxies have extended distributions of metals in their gas halos. We present predictions for the metal properties of massive galaxies and their gaseous halos from recent high resolution zoom-in simulations that include mechanical and radiation driven feedback from Active Galactic Nuclei (AGN). In these simulations, AGN launch high-velocity outflows, mimicking observed broad absorption line winds. By comparing two sets of simulations with and without AGN feedback, we show that our prescription for AGN feedback is capable of driving winds and enriching halo gas `inside-out' by spreading centrally enriched metals to the outskirts of galaxies, into the halo and beyond. The metal (iron) profiles of halos simulated with AGN feedback have a flatter slope than those without AGN feedback, consistent with recent X-ray observations. The predicted gas iron abundance of group scale galaxies simulated with AGN feedback is $Z_{\rm Fe} = 0.23$ $Z_{\rm Fe,\odot}$ at $0.5 r_{500}$, which is 2.5 times higher than that in simulations without AGN feedback. In these simulations, AGN winds are also important for the metal enrichment of the intergalactic medium, as the vast majority of metals ejected from the galaxy by AGN-driven winds end up beyond the halo virial radius.
2009.10184v1
2020-09-24
Large magnetoresistance in the iron-free pnictide superconductor LaRu$_2$P$_2$
The magnetoresistance of iron pnictide superconductors is often dominated by electron-electron correlations and deviates from the H$^2$ or saturating behaviors expected for uncorrelated metals. Contrary to similar Fe-based pnictide systems, the superconductor LaRu$_2$P$_2$ (T$_c$ = 4 K) shows no enhancement of electron-electron correlations. Here we report a non-saturating magnetoresistance deviating from the H$^2$ or saturating behaviors in LaRu$_2$P$_2$. We have grown and characterized high quality single crystals of LaRu$_2$P$_2$ and measured a magnetoresistance following H$^{1.3}$ up to 22 T. We discuss our result by comparing the bandstructure of LaRu$_2$P$_2$ with Fe based pnictide superconductors. The different orbital structures of Fe and Ru leads to a 3D Fermi surface with negligible bandwidth renormalization in LaRu$_2$P$_2$, that contains a large open sheet over the whole Brillouin zone. We show that the large magnetoresistance in LaRu$_2$P$_2$ is unrelated to the one obtained in materials with strong electron-electron correlations and that it is compatible instead with conduction due to open orbits on the rather complex Fermi surface structure of LaRu$_2$P$_2$.
2009.11585v1