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2020-09-28
Intrusion of MeV-TeV Cosmic-Rays into Molecular Clouds Studied by Ionization, the Neutral Iron Line, and Gamma-Rays
Low-energy (~MeV) cosmic rays (CRs) ionize molecular clouds and create the neutral iron line (Fe I K\alpha) at 6.4 keV. On the other hand, high-energy (>~ GeV) CRs interact with the dense cloud gas and produce gamma rays. Based on a one-dimensional model, we study the spatial correlation among ionization rates of gas, 6.4 keV line fluxes, and gamma-ray emissions from a molecular cloud illuminated by CRs accelerated at an adjacent supernova remnant. We find that the spatial distributions of these three observables depend on how CRs intrude the cloud and on the internal structure of the cloud. If the intrusion is represented by slow diffusion, the 6.4 keV line should be detected around the cloud edge where ionization rates are high. On the other hand, if CRs freely stream in the cloud, the 6.4 keV line should be observed where gamma rays are emitted. In the former, the cooling time of the CRs responsible for the 6.4 keV line is shorter than their cloud crossing time, and it is opposite in the latter. Although we compare the results with observations, we cannot conclude whether the diffusion or the free-streaming is dominantly realized. Our predictions can be checked in more detail with future X-ray missions such as XRISM and Athena and by observations of ionization rates that cover wider fields.
2009.13524v3
2020-10-02
Singular magnetic anisotropy in the nematic phase of FeSe
FeSe is arguably the simplest, yet the most enigmatic, iron-based superconductor. Its nematic but non-magnetic ground state is unprecedented in this class of materials and stands out as a current puzzle. Here, our NMR measurements in the nematic state of mechanically detwinned FeSe reveal that both the Knight shift and the spin-lattice relaxation rate 1/T_1 possess an in-plane anisotropy opposite to that of the iron pnictides LaFeAsO and BaFe2As2. Using a microscopic electron model that includes spin-orbit coupling, our calculations show that an opposite quasiparticle weight ratio between the d_xz and d_yz orbitals leads to an opposite anisotropy of the orbital magnetic susceptibility, which explains our Knight shift results. We attribute this property to a different nature of nematic order in the two compounds, predominantly bond-type in FeSe and onsite ferro-orbital in pnictides. The T_1 anisotropy is found to be inconsistent with existing neutron scattering data in FeSe, showing that the spin fluctuation spectrum reveals surprises at low energy, possibly from fluctuations that do not break C_4 symmetry. Therefore, our results reveal that important information is hidden in these anisotropies and they place stringent constraints on the low-energy spin correlations as well as on the nature of nematicity in FeSe.
2010.01020v1
2020-10-05
Magnetic Iron Nanocubes Effectively Capture Epithelial and Mesenchymal Cancer Cells
Current methods for capturing circulating tumor cells (CTCs) are based on the overexpression of cytokeratin (CK) or epithelial cell-adhesion molecule (EpCAM) on cancer cells. However, during the process of metastasis, tumor cells undergo epithelial to mesenchymal transition (EMT) that can lead to the loss of CK/EpCAM expression. Therefore, it is vital to develop a capturing technique independent of CK/EpCAM expression on the cancer cell. To develop this technique, it is important to identify common secondary oncogenic markers overexpressed on tumor cells before and after EMT. We analyzed the biomarker expression levels in tumor cells, before and after EMT, and found two common proteins human epidermal growth factor receptor 2 (Her2) and epidermal growth factor receptor (EGFR) whose levels remained unaffected. So, we synthesized immunomagnetic iron nanocubes covalently conjugated with antibodies of Her2 or EGFR to capture cancer cells irrespective of the EMT status. The nanocubes showed high specificity (6 to 9 fold) in isolating the cancer cells of interest from a mixture of cells spiked in serum. We characterized the captured cells for identifying their EMT status. Thus, we believe the results presented here would help in the development of novel strategies for capturing both primary and metastatic cancer cells from patients blood to develop an effective treatment plan.
2010.02129v1
2020-10-14
An extremely metal-deficient globular cluster in the Andromeda Galaxy
Globular clusters (GCs) are dense, gravitationally bound systems of thousands to millions of stars. They are preferentially associated with the oldest components of galaxies, and measurements of their composition can therefore provide insight into the build-up of the chemical elements in galaxies in the early Universe. We report a massive GC in the Andromeda Galaxy (M31) that is extremely depleted in heavy elements. Its iron abundance is about 800 times lower than that of the Sun, and about three times lower than in the most iron-poor GCs previously known. It is also strongly depleted in magnesium. These measurements challenge the notion of a metallicity floor for GCs and theoretical expectations that massive GCs could not have formed at such low metallicities.
2010.07395v1
2020-11-20
Photoionization Models for High Density Gas
Relativistically broadened and redshifted 6.4 -- 6.9 keV iron K lines are observed from many accretion powered objects, including X-ray binaries and active galactic nuclei (AGN). Existence of gas close to the central engine implies large radiation intensities and correspondingly large gas densities if the gas is to remain partially ionized. Simple estimates indicate that high gas densities are needed to allow survival of iron against ionization. These are high enough that rates for many atomic processes are affected by mechanisms related to interactions with nearby ions and electrons. Radiation intensities are high enough that stimulated processes can be important. Most models currently in use for interpreting relativistic lines use atomic rate coefficients designed for use at low densities and neglect stimulated processes. In our work so far we have presented atomic structure calculations with the goal of providing physically appropriate models at densities consistent with line-emitting gas near compact objects. In this paper we apply these rates to photoionization calculations, and produce ionization balance curves and X-ray emissivities and opacities which are appropriate for high densities and high radiation intensities. The final step in our program will be presented in a subsequent paper: Model atmosphere calculations which incorporate these rates into synthetic spectra.
2011.10603v2
2020-12-18
Observation of d-wave Pomeranchuk nematic order in floating monolayer FeSe on FeSe/STO
As a foundation of condensed matter physics, the normal states of most metals are successfully described by Landau Fermi liquid theory with quasi-particles and their Fermi surfaces (FSs). The FSs sometimes become deformed or gapped at low temperatures owing to quasi-particle interactions, known as FS instabilities. A notable example of a FS deformation that breaks only the rotation symmetry, namely Pomeranchuk instability, is the d-wave FS distortion, which is also proposed as one possible origin of electron nematicity in iron-based superconductors. However, no clear evidence has been made for its existence, mostly owing to the mixture of multiple orders. Here we report an unequivocally observation of the Pomeranchuk nematic order in floating monolayer (ML) FeSe on 1 ML-FeSe/SrTiO3 substrate. By using angle-resolve photoemission spectroscopy, we find remarkably that the dxz and dyz bands are degenerate at the Brillouin zone center (Gamma point), while their splitting is even larger at zone corner (M point), in stark contrast to that in bulk FeSe. Our detailed analysis show that the momentum-dependent nematic order in floating monolayer FeSe is coming from the d-wave Pomeranchuk instability at M point, shedding light on the origin of the ubiquitous nematicity in iron-based superconductors. Our results establish the single-layer high-Tc superconductors as an excellent material platform for investigating emergent quantum physics under complex intertwinement.
2012.10136v1
2020-12-19
Majorana bound states in vortex lattices on iron-based superconductors
Majorana quasi-particles may arise as zero-energy bound states in vortices on the surface of a topological insulator that is proximitized by a conventional superconductor. Such a system finds its natural realization in the iron-based superconductor FeTe$_{0.55}$Se$_{0.45}$ that combines bulk $s$-wave pairing with spin helical Dirac surface states, and which thus comprises the ingredients for Majorana modes in absence of an additional proximitizing superconductor. In this work, we investigate the emergence of Majorana vortex modes and lattices in such materials depending on parameters like the magnetic field strength and vortex lattice disorder. A simple 2D square lattice model here allows us to capture the basic physics of the underlying materials system. To address the problem of disordered vortex lattice, which occurs in real systems, we adopt the technique of the singular gauge transformation which we modify such that it can be used in a system with periodic boundary conditions. This approach allows us to go to larger vortex lattices than otherwise accessible, and is successful in replicating several experimental observations of Majorana vortex bound states in the FeTe$_{0.55}$Se$_{0.45}$ platform. Finally it can be related to a simple disordered Majorana lattice model that should be useful for further investigations on the role of interactions, and towards topological quantum computation.
2012.10588v2
2020-12-29
Supernova neutrino detection through neutron emission by nuclei
Neutrinos from core collapse supernovae can excite nuclei of some detector materials beyond their neutron emission thresholds. Detection of these neutrons can give valuable information about the supernova explosion mechanism and possibly also throw light on neutrino properties. In this article, we give a brief review of the basic physics of neutrino induced neutron emission and describe the results of some recent calculations of supernova neutrino induced neutrons for some specific target detector materials due to charged current (CC) interactions of the electron flavored neutrinos and antineutrinos as well as due to neutral current (NC) interactions of neutrinos and antineutrinos of all flavors with the detector nuclei. We highlight the fact that a detector material such as lead with a relatively large neutron excess produces neutrons dominantly through the CC interaction of the $\nu_e$s, whereas a material such as iron with small neutron excess produces neutrons dominantly through the combined NC interaction of all the six neutrino and antineutrino species. This raises the interesting possibility of probing the fraction of mu- and tau flavored neutrinos (which interact only through NC interaction) in the supernova neutrino flux by means of simultaneous detection of a supernova in a lead and an iron detector, for example.
2012.14888v1
2021-01-07
An injectable, self-healing and MMP-inhibiting hyaluronic acid gel via iron coordination
Regulating the activity of matrix metalloproteinases (MMPs) is a potential strategy for osteoarthritis (OA) therapy, although delivering this effect in a spatially and temporally localised fashion remains a challenge. Here, we report an injectable and self-healing hydrogel enabling factor-free MMP regulation and biomechanical competence in situ. The hydrogel is realised within one minute upon room temperature coordination between hyaluronic acid (HA) and a cell-friendly iron-glutathione complex in aqueous environment. The resultant gel displayed up to 300% in shear strain and tolerance towards ATDC 5 chondrocytes, in line with the elasticity and biocompatibility requirements for connective tissue application. Significantly enhanced inhibition of MMP-13 activity was achieved after 12 hours in vitro, compared with a commercial HA injection (OSTENIL PLUS). Noteworthy, 24-hour incubation of a clinical synovial fluid sample collected from a late-stage OA patient with the reported hydrogel was still shown to downregulate synovial fluid MMP activity (100.0 +/- 17.6 % --> 81.0 +/- 7.5 %), with at least comparable extent to the case of the OSTENIL PLUS-treated SF group (100.0 +/- 17.6 % --> 92.3 +/- 27.3 %). These results therefore open up new possibilities in the use of HA as both mechanically-competent hydrogel as well as a mediator of MMP regulation for OA therapy.
2101.02414v1
2021-01-26
Superconductivity at 40 K in lithiation-processed [(Fe,Al)(OH)2][FeSe]1.2 with a layered structure
Exploration of new superconductors has always been one of the research directions in condensed matter physics. We report here a new layered heterostructure of [(Fe,Al)(OH)2][FeSe]1.2, which is synthesized by the hydrothermal ion-exchange technique. The structure is suggested by a combination of X-ray powder diffraction and the electron diffraction (ED). [(Fe,Al)(OH)2][FeSe]1.2 is composed of the alternating stacking of tetragonal FeSe layer and hexagonal (Fe,Al)(OH)2 layer. In [(Fe,Al)(OH)2][FeSe]1.2, there exists mismatch between the FeSe sub-layer and (Fe,Al)(OH)2 sub-layer, and the lattice of the layered heterostructure is quasi-commensurate. The as-synthesized [(Fe,Al)(OH)2][FeSe]1.2 is non-superconducting due to the Fe vacancies in the FeSe layer. The superconductivity with a Tc of 40 K can be achieved after a lithiation process, which is due to the elimination of the Fe vacancies in the FeSe layer. The Tc is nearly the same as that of (Li,Fe)OHFeSe although the structure of [(Fe,Al)(OH)2][FeSe]1.2 is quite different from that of (Li,Fe)OHFeSe. The new layered heterostructure of [(Fe,Al)(OH)2][FeSe]1.2 contains an iron selenium tetragonal lattice interleaved with a hexagonal metal hydroxide lattice. These results indicate that the superconductivity is very robust for FeSe-based superconductors. It opens a path for exploring super-conductivity in iron-base superconductors.
2101.10641v1
2021-04-08
The EOS/Resolution Conspiracy: Convergence in Proto-Planetary Collision Simulations
We investigate how the choice of equation of state (EOS) and resolution conspire to affect the outcomes of giant impact (GI) simulations. We focus on the simple case of equal mass collisions of two Earth-like $0.5\,M_\oplus$ proto-planets showing that the choice of EOS has a profound impact on the outcome of such collisions as well as on the numerical convergence with resolution. In simulations where the Tillotson EOS is used, impacts generate an excess amount of vapour due to the lack of a thermodynamically consistent treatment of phase transitions and mixtures. In oblique collisions this enhances the artificial angular momentum (AM) transport from the planet to the circum-planetary disc reducing the planet's rotation period over time. Even at a resolution of $1.3 \times 10^6$ particles the result is not converged. In head-on collisions the lack of a proper treatment of the solid/liquid-vapour phase transition allows the bound material to expand to very low densities which in turn results in very slow numerical convergence of the critical specific impact energy for catastrophic disruption $Q_{RD}^*$ with increasing resolution as reported in prior work. The simulations where ANEOS is used for oblique impacts are already converged at a modest resolution of $10^5$ particles, while head-on collisions converge when they evidence the post-shock formation of a dense iron-rich ring, which promotes gravitational re-accumulation of material. Once sufficient resolution is reached to resolve the liquid-vapour phase transition of iron in the ANEOS case, and this ring is resolved, the value of $Q_{RD}^*$ has then converged.
2104.03559v2
2021-04-22
Chemical composition of stars with massive planets
Stellar parameters of 25 planet-hosting stars and abundances of Li, C, O, Na, Mg, Al, S, Si, Ca, Sc, Ti, V, Cr, Mn, Fe, Ni, Zn, Y, Zr, Ba, Ce, Pr, Nd, Sm and Eu, were studied based on homogeneous high resolution spectra and uniform techniques. The iron abundance [Fe/H] and key elements (Li, C, O, Mg, Si) indicative of the planet formation, as well as the dependencies of [El/Fe] on $T_{cond}$, were analyzed. The iron abundances determined in our sample stars with detected massive planets range within -0.3<[Fe/H]<0.4. The behaviour of [C/Fe], [O/Fe], [Mg/Fe] and [Si/Fe] relative to [Fe/H] is consistent with the Galactic Chemical Evolution trends. The mean values of C/O and [C/O] are <C/O>= 0.48 +/-0.07 and <[C/O]>=-0.07 +/-0.07, which are slightly lower than solar ones. The Mg/Si ratios range from 0.83 to 0.95 for four stars in our sample and from 1.0 to 1.86 for the remaining 21 stars. Various slopes of [El/Fe] vs. Tcond were found. The dependencies of the planetary mass on metallicity, the lithium abundance, the C/O and Mg/Si ratios, and also on the [El/Fe]-Tcond slopes were considered.
2104.10894v1
2021-05-02
High-energy magnetic excitations from heavy quasiparticles in CeCu$_2$Si$_2$
Magnetic fluctuations is the leading candidate for pairing in cuprate, iron-based and heavy fermion superconductors. This view is challenged by the recent discovery of nodeless superconductivity in CeCu$_2$Si$_2$, and calls for a detailed understanding of the corresponding magnetic fluctuations. Here, we mapped out the magnetic excitations in \ys{superconducting (S-type)} CeCu$_2$Si$_2$ using inelastic neutron scattering, finding a strongly asymmetric dispersion for $E\lesssim1.5$~meV, which at higher energies evolve into broad columnar magnetic excitations that extend to $E\gtrsim 5$ meV. While low-energy magnetic excitations exhibit marked three-dimensional characteristics, the high-energy magnetic excitations in CeCu$_2$Si$_2$ are almost two-dimensional, reminiscent of paramagnons found in cuprate and iron-based superconductors. By comparing our experimental findings with calculations in the random-phase approximation,we find that the magnetic excitations in CeCu$_2$Si$_2$ arise from quasiparticles associated with its heavy electron band, which are also responsible for superconductivity. Our results provide a basis for understanding magnetism and superconductivity in CeCu$_2$Si$_2$, and demonstrate the utility of neutron scattering in probing band renormalization in heavy fermion metals.
2105.00387v1
2021-05-19
An examination of local strain fields evolution in ductile cast iron through micromechanical simulations based on 3D imaging
Microscopic digital volume correlation (DVC) and finite element precoalescence strain evaluations are compared for two nodular cast iron specimens. Displacement fields from \textit{in-situ} 3D synchrotron laminography images are obtained by DVC. Subsequently the microstructure is explicitely meshed from the images considering nodules as voids. Boundary conditions are applied from the DVC measurement. Image segmentation-related uncertainties are taken into account and observed to be negligible with respect to the differences between strain levels. Macroscopic as well as local strain levels in coalescing ligaments between voids nucleated at large graphite nodules are compared. Macroscopic strain levels are consistently predicted. A very good agreement is observed for one of the specimens, while the strain levels for the second specimen presents some discrepancies. Limitations of the modeling and numerical framework are discussed in light of these differences. A discussion of the use of strain as coalescence indicator is initiated.
2105.09859v3
2021-05-24
The Surface of (16) Psyche from Thermal Emission and Polarization Mapping
The asteroid (16) Psyche is the largest of the M-type asteroids, which have been hypothesized to be the cores of disrupted planetesimals and the parent bodies of the iron meteorites. While recent evidence has collected against a pure metal composition for Psyche, its spectrum and radar properties remain anomalous. We observed (16) Psyche in thermal emission with the Atacama Large (sub-)Millimeter Array (ALMA) at a resolution of 30 km over 2/3 of its rotation. The diurnal temperature variations are at the $\sim$10 K level over most of the surface and are best fit by a smooth surface with a thermal inertia of 280$\pm$100 J m$^{-2}$ K$^{-1}$ s$^{-1/2}$. We measure a millimeter emissivity of 0.61$\pm$0.02, which we interpret via a model that treats the surface as a porous mixture of silicates and metals, where the latter may take the form of iron sulfides/oxides or alternatively as conducting metallic inclusions. The emissivity indicates a metal content of no less than 20\% and potentially much higher, but the polarized emission that should be present for a surface with $\geq$20\% metal content is almost completely absent. This requires a highly scattering surface, which may be due to the presence of reflective metallic inclusions. If such is the case, a consequence is that metal-rich asteroids may produce less polarized emission than metal-poor asteroids, exactly the opposite prediction from standard theory, arising from the dominance of scattering over the bulk material properties.
2105.11372v1
2021-08-03
Spectroscopy and structural investigation of iron phosphorus trisulfide -- FePS$_3$
Lamellar structures of transition metal phosphorus trisulfides possess strong intralayer bonding, albeit adjacent layers are held by weak van der Waals interactions. Those compounds received enormous interest due to their unique combination of optical and long-range magnetic properties. Among them, iron phosphorus trisulfide (FePS$_3$) gathered special attention for being a semiconductor with an absorption edge in the near-infrared, as well as showing an Ising-like anti-ferromagnetism. We report a successful growth of centimeter size bulk FePS$_3$ crystals with a chemical yield above 70%, whose crystallographic structure and composition were carefully identified by advanced electron microscopy methodologies, including atomic resolution elemental mapping, along with photoelectron spectroscopy. The knowledge on the optical activity of FePS$_3$ is extended utilizing temperature-dependent absorption and photoacoustic spectroscopies, while measurements were corroborated with density-functional theory calculations. Temperature-dependent experiments showed a small and monotonic band-edge energy shift down to 115 K and exposed the interconnected importance of electron-phonon coupling. Most of all, the correlation between the optical behavior and the magnetic phase transition is revealed, which shows the practical utilization of temperature-dependent optical absorption to investigate magnetic interactions.
2108.01742v3
2021-08-08
V488 Per revisited: no strong mid-infrared emission features and no evidence for stellar/sub-stellar companions
We present characterization of the planetary system architecture for V488 Per, the dustiest main sequence star known with a fractional infrared luminosity of ~16%. Far-infrared imaging photometry confirms the existence of an outer planetary system dust population with blackbody-fit temperature of ~130 K. Mid-infrared spectroscopy probing the previously-identified ~800 K inner planetary system dust population does not detect any obvious solid-state emission features, suggesting either large grain sizes that mute such emission and/or grain compositions dominated by species like amorphous carbon and metallic iron which do not produce such features. In the latter case, the presence of significant quantities of iron-rich material could be indicative of the active formation of a Mercury-like planet around V488 Per. In any event, the absence of solid-state emission features is very unusual among main sequence stars with copious amounts of warm orbiting dust particles; we know of no other such star whose mid-infrared spectrum lacks such features. Combined radial velocity monitoring and adaptive optics imaging find no evidence for stellar/sub-stellar companions within several hundred AU of V488 Per.
2108.03700v1
2021-08-20
Orbital-dependent modulation of the superconducting gap in uniaxially strained Ba$_{0.6}$K$_{0.4}$Fe$_2$As$_2$
Pairing symmetry which characterizes the superconducting pairing mechanism is normally determined by measuring the superconducting gap structure ($|\Delta_k|$). Here, we report the measurement of a strain-induced gap modulation ($\partial|\Delta_k|$) in uniaxially strained Ba$_{0.6}$K$_{0.4}$Fe$_2$As$_2$ utilizing angle-resolved photoemission spectroscopy and $in$-$situ$ strain-tuning. We found that the uniaxial strain drives Ba$_{0.6}$K$_{0.4}$Fe$_2$As$_2$ into a nematic superconducting state which breaks the four-fold rotational symmetry of the superconducting pairing. The superconducting gap increases on the $d_{yz}$ electron and hole pockets while it decreases on the $d_{xz}$ counterparts. Such orbital selectivity indicates that orbital-selective pairing exists intrinsically in non-nematic iron-based superconductors. The $d_{xz}$ and $d_{yz}$ pairing channels are balanced originally in the pristine superconducting state, but become imbalanced under uniaxial strain. Our results highlight the important role of intra-orbital scattering in mediating the superconducting pairing in iron-based superconductors. It also highlights the measurement of $\partial|\Delta_k|$ as an effective way to characterize the superconducting pairing from a perturbation perspective.
2108.08986v1
2021-08-25
Synthesis of a High-Capacity α-Fe2O3@C Conversion Anode and a High-Voltage LiNi0.5Mn1.5O4 Spinel Cathode and Their Combination in a Li-Ion Battery
A Li-conversion alpha-Fe2O3@C nanocomposite anode and a high-voltage LiNi0.5Mn1.5O4 cathode are synthesized in parallel, characterized, and combined in a Li-ion battery. alpha-Fe2O3@C is prepared via annealing of maghemite iron oxide and sucrose under an argon atmosphere and subsequent oxidation in air. The nanocomposite exhibits a satisfactory electrochemical response in a lithium half-cell, delivering almost 900 mA h g-1, as well as a significantly longer cycle life and higher rate capability compared to the bare iron oxide precursor. The LiNi0.5Mn1.5O4 cathode, achieved using a modified co-precipitation approach, reveals a well-defined spinel structure without impurities, a sub-micrometrical morphology, and a reversible capacity of ca. 120 mA h g-1 in a lithium half-cell with an operating voltage of 4.8 V. Hence, a lithium-ion battery is assembled by coupling the alpha-Fe2O3@C anode with the LiNi0.5Mn1.5O4 cathode. This cell operates at about 3.2 V, delivering a stable capacity of 110 mA h g-1 (referred to the cathode mass) with a Coulombic efficiency exceeding 97%. Therefore, this cell is suggested as a promising energy storage system with expected low economic and environmental impacts.
2108.11314v1
2021-08-25
Magnetic properties of BiFeO$_3$-BaTiO$_3$ ceramics in the morphotropic phase boundary: a role of crystal structure and structural parameters
A correlation between the crystal structure and magnetic properties of system (1-x)BiFeO$_3$-(x)BaTiO$_3$ with compounds across the morphotropic phase boundary was studied using X-ray and neutron diffraction, magnetometry, and Mossbauer spectroscopy measurements. Increase in the dopants content leads to the structural transition from the rhombohedral phase to the cubic phase via a formation of the two-phase region (0.2 < x < 0.33), wherein the magnetic structure changes from the modulated G-type antiferromagnetic to the collinear antiferromagnetic via a stabilization of the non-collinear antiferromagnetic phase with non-zero remanent magnetization. The value of magnetic moment calculated per iron ion based on the Mossbauer and neutron diffraction data decreases from m = 4.4 mB for the compound with x=0.25 to m=3.2 mB for the compound with x=0.35 testifying a dominance of 3+ oxidation state of the iron ions. Increase in the amount of the cubic phase leads to a reduction in the remanent magnetization from 0.02 emu.g for the compounds with the dominant rhombohedral phase (x < 0.27) down to about 0.001 emu/g for the compounds with dominant cubic structure (x >= 0.27). Rapid decrease in the remanent magnetization observed in the compounds across the phase coexistence region points at no direct correlation between the type of structural distortion and non-zero remanent magnetization, while the oxygen octahedra tilting is the key factor determining the presence of non-zero remanent magnetization.
2108.11447v1
2021-08-30
Thermodynamic Signatures of Diagonal Nematicity in RbFe$_2$As$_2$ Superconductor
Electronic nematic states with broken rotational symmetry often emerge in correlated materials. In most iron-based superconductors, the nematic anisotropy is oriented in the Fe-Fe direction of the iron square lattice. Recently, a novel type of nematicity along the diagonal Fe-As direction has been suggested in heavily hole-doped $A$Fe$_2$As$_2$ ($A=$ Rb or Cs). However, the transport studies focusing on the fluctuations of such nematicity have provided controversial results regarding the presence of diagonal nematic order. Here we report high-resolution heat capacity measurements under in-plane field rotation in RbFe$_2$As$_2$. While the temperature dependence of specific heat shows no discernible anomaly associated with the nematic transition, the field-angle dependence of specific heat near the superconducting transition (at $\sim 2.8$ K) reveals clear two-fold oscillations within the plane, providing thermodynamic evidence for the diagonal nematicity. Moreover, we find that M\"ossbauer spectroscopy sensitively probes the nematic transition at $\sim 50$ K with no evidence of static magnetism. These results imply that the diagonal nematicity in RbFe$_2$As$_2$ has a unique mechanism involving charge degrees of freedom, having unusual thermodynamic properties of the transition.
2108.13081v1
2021-09-03
A stellar census in globular clusters with MUSE. A new perspective on the multiple main sequences of $ω$ Centauri
$\omega$ Cen is a rare example of a globular cluster where the iron abundance of the stars spans more than one order of magnitude. Many spectroscopic investigations of its red-giant- and sub-giant- branches have revealed multiple peaks in the iron abundance distribution. The metallicity distribution of main-sequence (MS) stars is not well characterized yet, due to the faintness of the stars and lack of data. So far, almost all studies of MS stars are based on photometric measurements. Our goal is to investigate the metallicity distribution of a statistically significant sample of MS stars in $\omega$ Cen. In particular, we aim at revisiting the metallicity difference between the red and blue MS of the cluster. We used MUSE spectra obtained for the central region of $\omega$ Cen to derive metallicities for $\approx$4200 MS stars. We find that blue MS stars are on average $\approx$0.1 dex more metal-rich than their red counterparts. On the basis of this new estimate, we find that the two sequences can be fit on the Hubble Space Telescope color-magnitude diagram with two isochrones having the same global metallicity and age but a higher helium abundance for the blue MS, that is $\Delta Y \lesssim$ 0.1. Furthermore, we determine the average metallicity of the five main populations along $\omega$ Cen MS and these estimates are consistent with expectations from previous photometric studies.
2109.01540v2
2021-09-09
Collisional mixing between inner and outer solar system planetesimals inferred from the Nedagolla iron meteorite
The ungrouped iron meteorite Nedagolla is the first meteorite with bulk Mo, Ru, and Ni isotopic compositions that are intermediate between those of the non-carbonaceous (NC) and carbonaceous (CC) meteorite reservoirs. The Hf-W chronology of Nedagolla indicates that this mixed NC-CC isotopic composition was established relatively late, more than 7 million years after Solar System formation. The mixed NC-CC isotopic composition is consistent with the chemical composition of Nedagolla, which combines signatures of metal segregation under more oxidizing conditions (relative depletions in Mo and W), characteristic for CC bodies, and more reducing conditions (high Si and Cr contents), characteristic for some NC bodies, in a single sample. These data combined suggest that Nedagolla formed as the result of collisional mixing of NC and CC core material, which partially re-equilibrated with silicate mantle material that predominantly derives from the NC body. These mixing processes might have occurred during a hit-and-run collision between two differentiated bodies, which also provides a possible pathway for Nedagolla's extreme volatile element depletion. As such, Nedagolla provides the first isotopic evidence for early collisional mixing of NC and CC bodies that is expected as a result of Jupiter's growth.
2109.04224v1
2021-09-11
NuSTAR monitoring of MAXI J1348-630: evidence of high density disc reflection
We present the broadband spectral analysis of all the six hard, intermediate and soft state NuSTAR observations of the recently discovered transient black hole X-ray binary MAXI J1348-630 during its first outburst in 2019. We first model the data with a combination of a multi-colour disc and a relativistic blurred reflection, and, whenever needed, a distant reflection. We find that this simple model scheme is inadequate in explaining the spectra, resulting in a very high iron abundance. We, therefore, explore the possibility of reflection from a high-density disc. We use two different sets of models to describe the high-density disc reflection: relxill-based reflection models, and reflionx-based ones. The reflionx-based high-density disc reflection models bring down the iron abundance to around the solar value, while the density is found to be $10^{20.3-21.4} \rm cm^{-3}$. We also find evidence of a high-velocity outflow in the form of $\sim$7.3 keV absorption lines. The consistency between the best-fit parameters for different epochs and the statistical significance of the corresponding model indicates the existence of high-density disc reflection in MAXI J1348-630.
2109.05380v1
2021-09-14
Ultrafast Optical Spectroscopy Evidence of Pseudogap and Electron-Phonon Coupling in an Iron-Based Superconductor KCa$_2$Fe$_4$As$_4$F$_2$
We use ultrafast optical spectroscopy to study the nonequilibrium quasiparticle relaxation dynamics of the iron-based superconductor KCa$_2$Fe$_4$As$_4$F$_2$ with $T_c=33.5$ K. Our results reveal a possible pseudogap ($\Delta_{PG}$ = 2.4 $\pm$ 0.1 meV) below $T^*\approx 50$ K but prior to the opening of a superconducting gap ($\Delta_{SC}$(0) $\approx$ 4.3 $\pm$ 0.1 meV). Measurements under high pump fluence real two distinct, coherent phonon oscillations with 1.95 and 5.51 THz frequencies, respectively. The high-frequency $A_{1g}$(2) mode corresponds to the $c-$axis polarized vibrations of FeAs planes with a nominal electron-phonon coupling constant $\lambda_{A_{1g}(2)}$ = 0.194 $\pm$ 0.02. Our findings suggest that the pseudogap is likely a precursor of superconductivity, and the electron-phonon coupling may play an essential role in the superconducting pairing in KCa$_2$Fe$_4$As$_4$F$_2$.
2109.06460v2
2021-09-27
The Three-Dimensional Electronic Structure of LiFeAs: Strong-coupling Superconductivity and Topology in the Iron Pnictides
Amongst the iron-based superconductors, LiFeAs is unrivalled in the simplicity of its crystal structure and phase diagram. However, our understanding of this canonical compound suffers from conflict between mutually incompatible descriptions of the material's electronic structure, as derived from contradictory interpretations of the photoemission record. Here, we explore the challenge of interpretation in such experiments. By combining comprehensive photon energy- and polarization- dependent angle-resolved photoemission spectroscopy (ARPES) measurements with numerical simulations, we establish the providence of several contradictions in the present understanding of this and related materials. We identify a confluence of surface-related issues which have precluded unambiguous identification of both the number and dimensionality of the Fermi surface sheets. Ultimately, we arrive at a scenario which supports indications of topologically non-trivial states, while also being incompatible with superconductivity as a spin-fluctuation driven Fermi surface instability.
2109.13276v1
2021-10-12
Vortex dynamics and second magnetization peak in the iron-pnictide superconductor Ca$_{0.82}$La$_{0.18}$Fe$_{0.96}$Ni$_{0.04}$As$_2$
We report the studies of detailed magnetic relaxation and isothermal magnetization measurements in the vortex state of the 112-type iron-pnictide Ca$_{0.82}$La$_{0.18}$Fe$_{0.96}$Ni$_{0.04}$As$_2$ superconductor with $T_c$ $\sim$ 22 K. In the isothermal $M(H)$, a well defined second magnetization peak (SMP) feature is observed in the entire temperature range below $T_c$ for measurements with $H$ $\parallel$ $c$-axis. However, for $H$ $\parallel$ $ab$-planes, the SMP feature is suppressed at low temperatures, which might be due to 2D Josephson vortices forming at low temperatures and high magnetic fields in such an anisotropic system. A rigorous analysis considering the magnetic relaxation data for $H$ $\parallel$ $c$-axis suggests an elastic to plastic pinning crossover across $H_p$, which also seems accompanied with a possible phase transition in vortex lattice near $H_p$. Moreover, point disorder and surface defects are likely to be the dominant sources of pinning, which contribute to the $\delta l$-type of pinning in the sample. A high $J_c$, in access of 10$^5$ A/cm$^2$ observed could potentially make this material technologically important.
2110.05677v1
2021-10-19
Generalized estimates for the density of oxide scale in the range from 0 C to 1300 C
Oxide scale formed on the surface of steel products during high-teperature processes is studied as a composite material, the main solid components of which, in general, are wustite, magnetite, hematite and metallic iron. To estimate the density of each of these components in the temperature range from 0 C to 1300 C, formulas are proposed that are consistent with the empirical functions of the coefficient of linear thermal expansion, which the authors obtained earlier by generaizing data from open sources. The Curie and polymorphic transformation temperatures are included in these generalized formulas as variable parameters, which allows one to take into account the movability of phase transitions due to impurities, crystal lattice defects, particle sizes, cooling rate, and other factors. When specifying the particular values of critical temperatures, the other parameters of the formulas are recalculated automatically. In a particular form, the proposed formulas correspond to the basic values of critical temperatures. According to the calculation examples given, the true (not including pores) density of oxide scale can be about 5200 to 5600 kg/m3, depending on the temperature and percentage of components, whereby a local density minimum may be observed in the region of 570 C due to eutectoid decomposition of wustite into magnetite and iron. The proposed methods are recommended for use in mathematical simulation of processing of steel products in the presence of oxide scale on its surface.
2110.09791v1
2021-10-26
Stochastic Low Frequency Variability in 3-Dimensional Radiation Hydrodynamical Models of Massive Star Envelopes
Increasing main sequence stellar luminosity with stellar mass leads to the eventual dominance of radiation pressure in stellar envelope hydrostatic balance. As the luminosity approaches the Eddington limit, additional instabilities (beyond conventional convection) can occur. These instabilities readily manifest in the outer envelopes of OB stars, where the opacity increase associated with iron yields density and gas pressure inversions in 1D models. Additionally, recent photometric surveys (e.g. TESS) have detected excess broadband low frequency variability in power spectra of OB star lightcurves, called stochastic low frequency variability (SLFV). This motivates our novel 3D Athena++ radiation hydrodynamical (RHD) simulations of two 35$\,$M$_\odot$ star envelopes (the outer $\approx$15$\%$ of the stellar radial extent), one on the zero-age main sequence and the other in the middle of the main sequence. Both models exhibit turbulent motion far above and below the conventional iron opacity peak convection zone (FeCZ), obliterating any ``quiet" part of the near-surface region and leading to velocities at the photosphere of 10-100$\,$km$\,$s$^{-1}$, directly agreeing with spectroscopic data. Surface turbulence also produces SLFV in model lightcurves with amplitudes and power-law slopes that are strikingly similar to those of observed stars. The characteristic frequencies associated with SLFV in our models are comparable to the thermal time in the FeCZ ($\approx$3-7$\,$days$^{-1}$). These simulations, which have no free parameters, are directly validated by observations and, though more models are needed, we remain optimistic that 3D RHD models of main sequence O star envelopes exhibit SLFV originating from the FeCZ.
2110.13944v1
2021-12-01
Orbital-Selective High-Temperature Cooper Pairing Developed in the Two-Dimensional Limit
The orbital multiplicity in multiband superconductors yields orbital differentiation in normal-state properties, and can lead to orbital-selective spin-fluctuation Cooper pairing. This phenomenon has become increasingly pivotal in clarifying the pairing 'enigma' particularly for multiband high-temperature superconductors. In one-unit-cell (1-UC) FeSe/SrTiO3, the thinnest and highest-Tc member of iron-based superconductors, the standard electron-hole Fermi pocket nesting scenario is apparently not applicable since the Gamma-centered hole pockets are absent, so the actual pairing mechanism is the subject of intense debate. Here, by measuring high-resolution Bogoliubov quasiparticle interference, we report observations of highly anisotropic magnetic Cooper pairing in 1-UC FeSe. From a theoretical point of view, it is important to incorporate effects of electronic correlations within a spin-fluctuation pairing calculation, where the dxy orbital becomes coherence-suppressed. The resulting pairing gap is compatible with the experimental findings, which suggests that high-Tc Cooper pairing with orbital selectivity applies to 1-UC FeSe. Our findings imply the general existence of orbital selectivity in iron-based superconductors and the universal importance of electron correlations in high-Tc superconductors.
2112.00383v1
2021-12-05
Optical singly-ionized iron emission in radio-quiet and relativistically jetted active galactic nuclei
The issue of the difference between optical and UV properties of radio-quiet and radio-loud (relativistically "jetted") active galactic nuclei (AGN) is a long standing one, related to the fundamental question of why a minority of powerful AGN possess strong radio emission due to relativistic ejections. This paper examines a particular aspect: the singly-ionized iron emission in the spectral range 4400 -- 5600 A, where the prominent HI H$\beta$ and [OIII] 4959, 5007 lines are also observed. We present a detailed comparison of the relative intensity of Fe II multiplets in the spectral types of the quasar main sequence where most jetted sources are found, and afterwards discuss radio-loud narrow-line Seyfert 1 (NLSy1) nuclei with $\gamma$-ray detection and with prominent Fe II emission. An Fe II template based on I Zw 1 provides an accurate representation of the optical Fe II emission for RQ and, with some caveats, also for RL sources. CLOUDY photoionization simulations indicate that the observed spectral energy distribution can account for the modest Fe II emission observed in composite radio-loud spectra. However, spectral energy differences alone cannot account for the stronger Fe II emission observed in radio-quiet sources, for similar physical parameters. As for RL NLSy1s, they do not seem to behave like other RL sources, likely because of their different physical properties that could be ultimately associated with a higher Eddington ratio.
2112.02632v1
2021-12-10
Random-strain-induced correlations in materials with intertwined nematic and magnetic orders
Electronic nematicity is rarely observed as an isolated instability of a correlated electron system. Instead, in iron pnictides and in certain cuprates and heavy-fermion materials, nematicity is intertwined with an underlying spin-stripe or charge-stripe state. As a result, random strain, ubiquitous in any real crystal, creates both random-field disorder for the nematic degrees of freedom and random-bond disorder for the spin or charge ones. Here, we put forward an Ashkin-Teller model with random Baxter fields to capture the dual role of random strain in nematic systems for which nematicity is a composite order arising from a stripe state. Using Monte Carlo to simulate this $\textit{random Baxter-field model}$, we find not only the expected break-up of the system into nematic domains, but also the emergence of nontrivial disorder-promoted magnetic correlations. Such correlations enhance and tie up the fluctuations associated with the two degenerate magnetic stripe states from which nematicity arises, leaving characteristic signatures in the spatial profile of the magnetic domains, in the configurational space of the spin variables, and in the magnetic noise spectrum. We discuss possible experimental manifestations of these effects in iron-pnictide superconductors. Our work establishes the random Baxter-field model as a more complete alternative to the random-field Ising model to describe complex electronic nematic phenomena in the presence of disorder.
2112.05769v1
2021-12-15
A Suzaku sample of unabsorbed narrow-line and broad-line Seyfert 1 galaxies: II. Iron emission and absorption
A sample of 22 narrow-line Seyfert 1 (NLS1) and 47 broad-line Seyfert 1 (BLS1) galaxies observed with Suzaku is used to examine the Fe K band properties of each group. Three different models are used to examine the presence of: narrow neutral Fe Ka line at 6.4 keV and ionised Fe xxv and Fe xxvi emission lines (model A); a broad emission feature at around 6 - 7 keV (model B); and an absorption edge at 7.1 keV (model C). In all three models, the neutral Fe Ka line is weaker (lower luminosity and equivalent width) in NLS1s than in BLS1s. Model (B) also finds a more significant broad component (larger equivalent width) in NLS1s than in BLS1s. The feature does not appear to be an artefact of steeper spectra in NLS1s, but rather an intrinsic property of these sources. From model (C), the optical depth of the absorption edge appears comparable between the two samples. When comparing the absorption with the emission line properties, NLS1s seem to exhibit a lower ratio of emission-to-absorption of iron than BLS1s, and than expected based on the fluorescence yield. The observed differences may arise from different torus geometries (e.g. larger opening angle in NLS1s), and/or additional sources of Fe K emission and absorption in NLS1s beyond pure fluorescence (e.g. originating in the disc and broad line region).
2112.08127v1
2021-12-15
Stellar population astrophysics (SPA) with the TNG -- The chemical content of the red supergiant population in the Perseus complex
Context. The Perseus complex in the outer disk of the Galaxy hosts a number of clusters and associations of young stars. Gaia is providing a detailed characterization of their kinematic structure and evolutionary properties. Aims. Within the SPA Large Programme at the TNG, we secured HARPS-N and GIANO-B high-resolution optical and near-infrared (NIR) spectra of the young red supergiant (RSG) stars in the Perseus complex, in order to obtain accurate radial velocities, stellar parameters and detailed chemical abundances. Methods. We used spectral synthesis to best-fit hundreds of atomic and molecular lines in the spectra of the observed 27 RSGs. We obtained accurate estimates of the stellar temperature, gravity, micro and macro turbulence velocities and chemical abundances for 25 different elements. We also measured the $^{12}$C/$^{13}$C abundance ratio. Results. Our combined optical and NIR chemical study provides homogeneous half-solar iron with a small dispersion, about solar-scaled abundance ratios for the iron-peak, alpha and other light elements and a small enhancement of Na, K and neutron-capture elements, consistent with the thin disk chemistry traced by older stellar populations at a similar Galactocentric distance of about 10 kpc. We inferred enhancement of N, depletion of C and of the $^{12}$C/$^{13}$C isotopic abundance ratio, consistent with mixing processes in the stellar interiors during the RSG evolution.
2112.08402v1
2021-12-28
Simulations of globular clusters within their parent galaxies: Metallicity spreads and anomalous precursor populations
Recent observations of globular clusters (GCs) suggest that elemental abundance variations may exist between first-generation (1G) stars. We propose that metal abundance ('metallicity') spreads within GC forming giant molecular clouds (GMCs) can influence the iron abundances of future cluster members. To investigate this, we use original hydrodynamical simulations to model GMC formation in a high redshift dwarf galaxy. Our simulations self-consistently model physical processes such as stellar feedback, dust formation and destruction, and molecular gas formation on dust grains, making them well suited to the study of GMC formation. We conclude that iron abundance variations in GMCs are due to the merging of gas clumps and self-enrichment processes. The metallicity dispersions of GC forming clumps is ~0.1 dex, reflecting a growing number of studies that claim a non-zero dispersion within GCs. The galactic gas fraction is a key parameter for the formation of clumps and the metallicity 'floor' observed for both Galactic and extragalactic GCs are associated with the parent galaxy's capacity to form massive GMCs. Finally, we argue that GMCs have the potential to trap surrounding metal-poor galactic disc stars, which we interpret as a precursor population (0G). These low metallicity stars are representative of the [Fe/H] value of the host dwarf and thus the chemistry of this 0G may be a fossilized record of the parent galaxy. These results depend on the initial metallicity and radial gradient of the galaxy, the threshold gas density for star formation, and the star formation prescription.
2112.13971v1
2022-01-04
Reconstruction of Air-Shower Parameters Through the Lateral Distribution Function of Ultra-High Energy Particles
In this study, the necessity of the simulation study for exploring the interactions of ultra-high energy particles cosmic rays was examined. Different hadronic interaction models such as (SIBYLL, QGSJET, and EPOS) were simulated by using air showers simulation AIRES system (version 19.04.00). Also, the charged particle density of Extensive Air Showers (EAS) was calculated by estimating the lateral distribution function (LDF). Moreover, the LDF simulation of the two primary particles (proton and iron nuclei) was performed, taking into account their primary energies effect and the zenith angle of charged particles that produced in the EAS, within the energy range (10^17-10^19) eV. At extremely high energies (10^17, 10^18, and 10^19) eV, new parameters as a function of the primary energy were obtained by fitting the lateral distribution curves of EAS using Sigmoidal function (Logistic model). Comparison of the results showed a good agreement between the values obtained from the parameterized LDF using Sigmoidal function with experimental results by AGASA EAS observatory for the primaries proton as well iron nuclei, with the production of (electron positron) pair and the charged muons secondary particles at high energy about 10^19 eV and (theta = 0 degree).
2201.01368v1
2022-02-01
Optical Properties of C$-$rich ($^{12}$C, SiC and FeC) Dust Layered Structure of Massive Stars
The composition and structure of interstellar dust are important and complex for the study of the evolution of stars and the \textbf{interstellar medium} (ISM). However, there is a lack of corresponding experimental data and model theories. By theoretical calculations based on ab-initio method, we have predicted and geometry optimized the structures of Carbon-rich (C-rich) dusts, carbon ($^{12}$C), iron carbide (FeC), silicon carbide (SiC), even silicon ($^{28}$Si), iron ($^{56}$Fe), and investigated the optical absorption coefficients and emission coefficients of these materials in 0D (zero$-$dimensional), 1D, and 2D nanostructures. Comparing the \textbf{nebular spectra} of the supernovae (SN) with the coefficient of dust, we find that the optical absorption coefficient of the 2D $^{12}$C, $^{28}$Si, $^{56}$Fe, SiC and FeC structure corresponds to the absorption peak displayed in the infrared band (5$-$8) $\mu$$m$ of the spectrum at 7554 days after the SN1987A explosion. And it also corresponds to the spectrum of 535 days after the explosion of SN2018bsz, when the wavelength in the range of (0.2$-$0.8) and (3$-$10) $\mu$$m$. Nevertheless, 2D SiC and FeC corresponds to the spectrum of 844 days after the explosion of SN2010jl, when the wavelength is within (0.08$-$10) $\mu$$m$. Therefore, FeC and SiC may be the second type of dust in SN1987A corresponding to infrared band (5$-$8) $\mu$$m$ of dust and may be in the ejecta of SN2010jl and SN2018bsz.
2202.00260v1
2022-01-30
Ultrahigh-Pressure Magnesium Hydrosilicates as Reservoirs of Water in Early Earth
The origin of water on the Earth is a long-standing mystery, requiring a comprehensive search for hydrous compounds, stable at conditions of the deep Earth and made of Earth-abundant elements. Previous studies usually focused on the current range of pressure-temperature conditions in the Earth's mantle and ignored a possible difference in the past, such as the stage of the core-mantle separation. Here, using ab initio evolutionary structure prediction, we find that only two magnesium hydrosilicate phases are stable at megabar pressures, $\alpha$-Mg$_2$SiO$_5$H$_2$ and $\beta$-Mg$_2$SiO$_5$H$_2$, stable at 262-338 GPa and >338 GPa,respectively (all these pressures now lie within the Earth's iron core). Both are superionic conductors with quasi-one-dimensional proton diffusion at relevant conditions. In the first 30 million years of Earth's history, before the Earth's core was formed, these must have existed in the Earth, hosting much of Earth's water. As dense iron alloys segregated to form the Earth's core, Mg$_2$SiO$_5$H$_2$ phases decomposed and released water. Thus, now-extinct Mg$_2$SiO$_5$H$_2$ phases have likely contributed in a major way to the evolution of our planet.
2202.00752v1
2022-03-30
The Chemical Composition of Extreme-Velocity Stars
Little is known about the origin of the fastest stars in the Galaxy. Our understanding of the Milky Way and surrounding dwarf galaxies chemical evolution history allows us to use the chemical composition of a star to investigate its origin, and say whether a star was formed in-situ or was accreted. However, the fastest stars, the hypervelocity stars, are young and massive and their chemical composition has not yet been analyzed. Though it is difficult to analyze the chemical composition of a massive young star, we are well versed in the analysis of late-type stars. We have used high-resolution ARCES/3.5m Apache Point Observatory, MIKE/Magellan spectra to study the chemical details of 15 late-type hypervelocity stars candidates. With Gaia EDR3 astrometry and spectroscopically determined radial velocities we found total velocities with a range of $274$ - $520$ km s$^{-1}$ and mean value of $381$ km s$^{-1}$. Therefore, our sample stars are not fast enough to be classified as Hypervelocity stars, and are what is known as extreme-velocity stars. Our sample has a wide iron abundance range of $-2.5 \le \mathrm{[Fe/H]} \le -0.9$. Their chemistry indicate that at least 50\% of them are accreted extragalactic stars, with iron-peak elements consistent with prior sub-Chandrasekhar mass type Ia supernova enrichment. Without indication of binary companions, their chemical abundances and orbital parameters are indicative that they are the accelerated tidal debris of disrupted dwarf galaxies.
2203.16364v1
2022-04-08
Estimation of Nitrogen-to-Iron Abundance Ratios From Low-Resolution Spectra
We present a method to determine nitrogen abundance ratios with respect to iron ([N/Fe]) from molecular CN-band features observed in low-resolution ($R \sim$ 2000) stellar spectra obtained by the Sloan Digital Sky Survey (SDSS) and the Large Sky Area Multi-Object Fiber Spectroscopic Telescope (LAMOST). Various tests are carried out to check the systematic and random errors of our technique, and the impact of signal-to-noise (S/N) ratios of stellar spectra on the determined [N/Fe]. We find that the uncertainty of our derived [N/Fe] is less than 0.3 dex for S/N ratios larger than 10 in the ranges $T_{eff}$ = [4000, 6000] K, log g = [0.0, 3.5], [Fe/H] = [--3.0, 0.0], [C/Fe] = [--1.0, +4.5], and [N/Fe] = [--1.0, +4.5], the parameter space that we are interested in to identify N-enhanced stars in the Galactic halo. A star-by-star comparison with a sample of stars with [N/Fe] estimates available from the Apache Point Observatory Galactic Evolution Experiment (APOGEE) also suggests a similar level of uncertainty in our measured [N/Fe], after removing its systematic error. Based on these results, we conclude that our method is able to reproduce [N/Fe] from low-resolution spectroscopic data, with an uncertainty sufficiently small to discover N-rich stars that presumably originated from disrupted Galactic globular clusters.
2204.03933v1
2022-04-08
Possible Implications of Relatively High Levels of Initial $^{60}$Fe in Iron Meteorites for the Non-Carbonaceous -- Carbonaceous Meteorite Dichotomy and Solar Nebula Formation
Cook et al. (2021) found that iron meteorites have an initial abundance ratio of the short-lived isotope $^{60}$Fe to the stable isotope $^{56}$Fe of $^{60}$Fe/$^{56}$Fe $\sim$ $(6.4 \pm 2.0) \times 10^{-7}$. This appears to require the injection of live $^{60}$Fe from a Type II supernova (SN II) into the presolar molecular cloud core, as the observed ratio is over a factor of ten times higher than would be expected to be found in the ambient interstellar medium (ISM) as a result of galactic chemical evolution. The supernova triggering and injection scenario offers a ready explanation for an elevated initial $^{60}$Fe level, and in addition provides a physical mechanism for explaining the non-carbonaceous -- carbonaceous (NC-CC) dichotomy of meteorites. The NC-CC scenario hypothesizes the solar nebula first accreted material that was enriched in supernova-derived nuclides, and then later accreted material depleted in supernova-derived nuclides. While the NC-CC dichotomy refers to stable nuclides, not short-lived isotopes like $^{60}$Fe, the SN II triggering hypothesis provides an explanation for the otherwise unexplained change in nuclides being accreted by the solar nebula. Three dimensional hydrodynamical models of SN II shock-triggered collapse show that after triggering collapse of the presolar cloud core, the shock front sweeps away the local ISM while accelerating the resulting protostar/disk to a speed of several km/s, sufficient for the protostar/disk system to encounter within $\sim$ 1 Myr the more distant regions of a giant molecular cloud complex that might be expected to have a depleted inventory of supernova-derived nuclides.
2204.04134v1
2022-04-21
Ferrous Metal Matrix Composites Status Scope and Challenges
The present paper is an effort to culminate the status, scopes and challenges in the development of ferrous metal matrix composites (FMMCs). The FMMCs are old but less in use than the non-ferrous metal matrix composites (NFMMCs), as far as literature and actual applications are concerned. Therefore, this stimulates the exploration of the reasons behind the scarcity of literature and field applications of the FMMCs, which must be investigated scientifically. The powder metallurgy route is the most used process for fabricating iron and steel based FMMCs by reinforcing particulates. At the same time, the in-situ method has been used for the fabrication and cast iron-based FMMCs. The main characteristics being considered during the designing and fabrication of FMMCs are wear resistance and improved specific mechanical properties. To fabricate cheaper and eco-friendly FMMCs, traditionally used costly reinforcements such as SiC, WC, TiC, SiO2, TiO2, TiB2 are required to be replaced by inexpensive industrial wastes like red-mud, fly-ashes and grinding swarf. The data extracted from the web of science exhibited that the FMMCs have been researched less than the NFMMCs. The increasing number of research papers on FMMCs indicates a bright future. FMMCs are going to be a favourite topic among researchers and manufacturers. Higher strengths, wear resistance, dimensional stability at elevated temperatures, and, most importantly, the lower cost will put forward the FMMCs as a stiff competitor of NFMMCs. In developing and mass production of FMMCs for field applications, challenges like oxidation and higher weight still require special research efforts.
2204.09999v2
2022-04-21
Detection of CO emission lines in the dayside atmospheres of WASP-33b and WASP-189b with GIANO
Ultra-hot Jupiters (UHJs) are expected to possess temperature inversion layers in their dayside atmospheres. Recent thermal emission observations have discovered several atomic and molecular species along with temperature inversions in UHJs. We observed the thermal emission spectra of two UHJs (WASP-33b and WASP-189b) with the GIANO-B high-resolution near-infrared spectrograph. Using the cross-correlation technique, we detected carbon monoxide (CO) in the dayside atmospheres of both planets. The detected CO lines are in emission, which agrees with previous discoveries of iron emission lines and temperature inversions in the two planets. This is the first detection of CO lines in emission with high-resolution spectroscopy. Further retrieval work combining the CO lines with other spectral features will enable a comprehensive understanding of the atmospheric properties such as temperature structures and C/O ratios. The detected CO and iron emission lines of WASP-189b have redshifted radial velocities of several km/s, which likely originate from a dayside to nightside wind in its atmosphere. Such a redshifted velocity has not been detected for the emission lines of WASP-33b, suggesting that the atmospheric circulation patterns of the two UHJs may be different.
2204.10158v1
2022-05-17
A Disc Reflection Model for Ultra-Soft Narrow-Line Seyfert 1 Galaxies
We present a detailed analysis of the XMM-Newton observations of five narrow-line Seyfert 1 galaxies (NLS1s). They all show very soft continuum emission in the X-ray band with a photon index of $\Gamma\gtrsim 2.5$. Therefore, they are referred to as `ultra-soft' NLS1s in this paper. By modeling their optical/UV-X-ray spectral energy distribution (SED) with a reflection-based model, we find indications that the disc surface in these ultra-soft NLS1s is in a higher ionisation state than other typical Seyfert 1 AGN. Our best-fit SED models suggest that these five ultra-soft NLS1s have an Eddington ratio of $\lambda_{\rm Edd}=1-20$ assuming available black hole mass measurements. In addition, our models infer that a significant fraction of the disc energy in these ultra-soft NLS1s is radiated away in the form of non-thermal emission instead of the thermal emission from the disc. Due to their extreme properties, X-ray observations of these sources in the iron band are particularly challenging. Future observations, e.g. from Athena, will enable us to have a clearer view of the spectral shape in the iron band and thus distinguish the reflection model from other interpretations of their broadband spectra.
2205.08236v1
2022-05-28
Spectral Evidence for Unidirectional Charge Density Wave in Detwinned BaNi$_2$As$_2$
The emergence of unconventional superconductivity in proximity to intertwined electronic orders is especially relevant in the case of iron-based superconductors. Such order consists of an electronic nematic order and a spin density wave in these systems. BaNi$_2$As$_2$, like its well-known iron-based analog BaFe$_2$As$_2$, also hosts a symmetry-breaking structural transition that is coupled to a unidirectional charge density wave (CDW), providing a novel platform to study intertwined orders. Here, through a systematic angle-resolved photoemission spectroscopy study combined with a detwinning $B_1g$ uniaxial strain, we identify distinct spectral evidence of band evolution due to the structural transition as well as CDW-induced band folding. In contrast to the nematicity and spin density wave in BaFe$_2$As$_2$, the structural and CDW order parameters in BaNi$_2$As$_2$ are observed to be strongly coupled and do not separate in the presence of uniaxial strain. Our measurements point to a likely lattice origin of the CDW in BaNi$_2$As$_2$.
2205.14339v1
2022-06-02
Lithium detection in red supergiant stars of the Perseus complex
We present the first systematic study of lithium abundance in a chemically homogeneous sample of 27 red supergiants (RSGs) in the young Perseus complex. For these stars, accurate stellar parameters and detailed chemical abundances of iron and iron peak, CNO, alpha, light and neutron-capture elements have been already obtained by means of high resolution optical and near-infrared spectroscopy. The observed RSGs have half-solar metallicity, 10-30 Myr age, bolometric luminosities in the 10$^4$-10$^5$ L$_{\odot}$ range and likely mass progenitors in the 9-14 M$_{\odot}$ range. We detected the optical Li I doublet in eight out of the 27 observed K and M type RSGs, finding relatively low A(Li)$<$1.0 dex abundances, while for the remaining 19 RSGs upper limits of A(Li)$<$-0.2 dex have been set. Warmer and less luminous (i.e. likely less massive) as well as less mixed (i.e. with lower [C/N] and $^{12}$C/$^{13}$C depletion) RSGs with Li detection show somewhat higher Li abundances. In order to explain Li detection in $\sim$30\% of the observed RSGs, we speculate that some stochasticity and a scenario where Li was not completely destroyed in the convective atmospheres and/or a secondary production took place during the post-Main Sequence evolution, should be at work.
2206.01218v1
2022-06-15
Hyperfine fields at $^{66}$Ga, $^{67,69}$Ge implanted into iron and gadolinium hosts at 6 K, and applications to g-factor measurements
Isomers in $^{66}$Ga, $^{67}$Ge, and $^{69}$Ge were recoil-implanted into ferromagnetic hosts of iron and gadolinium at $\approx 6$~K, and the hyperfine magnetic fields were determined by Time Differential Perturbed Angular Distribution (TDPAD) measurements. The hyperfine field strengths at $\approx 6$~K are compared to the results of previous higher-temperature measurements and the amplitudes of the $R(t)$ functions are compared to empirical expectations. The results show that gadolinium can be a suitable host for high-precision in-beam $g$-factor measurements. The results of new $g$-factor measurements for isomers in $^{66}$Ga and $^{67}$Ge are $g(^{66}$Ga$,7^{-}) = +0.126(4)$, supporting a $[\pi_{f5/2} \otimes \nu g_{9/2}]_{7^-}$ configuration assignment, and $g(^{67}$Ge$,\frac{9}{2}^{+})=-0.1932(22)$, derived from a new measurement of the ratio $g(^{67}\mathrm{Ge})/g(^{69}\mathrm{Ge}) = 0.869(9)$. These values are in agreement with previous results. The $R(t)$ amplitudes indicate that the nuclear alignment produced in the isomeric states was significantly lower than the empirically expected $\sigma/I \approx 0.35$.
2206.07294v1
2022-06-23
Size-dependent Failure Behavior of Lithium-Iron Phosphate Battery under Mechanical Abuse
Under mechanical abuse conditions, the failure of lithium-ion batteries occurs in various stages characterized by different force, temperature and voltage response which require it's in-situ measurements for analysis. Firstly, four sizes of commercially available lithium-iron phosphate batteries (LFPB) viz. 18650, 22650, 26650, and 32650 are subjected to quasi static lateral, longitudinal compression, and nail penetration tests. The failure, characterized by the voltage drop and temperature rise, at the onset of the first internal short-circuit (ISC), is identified by Aurdino-based voltage sensor module and temperature measurement module, respectively. The battery failure load and peak temperature at the onset of ISC are found to rely on the battery size strongly. The failure is observed to be delayed for small-sized 18650 batteries during lateral compression, unlike longitudinal compression and nail penetration test. At the onset of the short circuit, the temperature rise above the ambient value is different for different LFPBs. It is found to be maximum (64.4 degree C ) for LFPB 32650 under longitudinal compression and minimum (29.5 degree C) under lateral compression tests amongst the considered geometries. Further, LFPB 26650 exhibited a balanced thermal behavior during the considered abused condition. Such data can be sensed timely for effective thermal management and improved safety of lithium-ion batteries.
2206.11732v2
2022-08-03
Light-induced dynamics of liquid-crystalline droplets on the surface of iron-doped lithium niobate crystals
We investigated the effect of a photovoltaic field generated on the surface of iron-doped lithium niobate crystals on droplets of a ferroelectric nematic liquid crystalline and a standard nematic liquid crystalline material deposited on this surface. When such assembly is illuminated with a laser beam, a wide range of dynamic phenomena are initiated. Droplets located outside the laser spot are dragged in the direction of the illuminated area, while droplets located inside the illuminated region tend to bridge each other and rearrange into tendril-like structures. In the ferroelectric nematic phase (NF) these processes take place via the formation of conical spikes evolving into jet streams, similar to the behavior of droplets of conventional dielectric liquids exposed to overcritical electric fields. However, in contrast to conventional liquids, the jet streams of the NF phase exhibit profound branching. In the nematic phase (N) of both the ferroelectric nematic and the standard nematic material, dynamic processes occur via smooth-edged continuous features typical for conventional liquids subjected to under-critical fields. The difference in dynamic behavior is attributed to the large increase of dielectric permittivity in the ferroelectric nematic phase with respect to the dielectric permittivity of the nematic phase.
2208.02318v1
2022-09-07
Transport evidence for the surface state and spin-phonon interaction in FeTe$_{0.5}$Se$_{0.5}$
The iron chalcogenides have been proved to be intrinsic topological superconductors to implement quantum computation because of their unique electronic structures. The topologically nontrivial surface states of FeTe$_{0.5}$Se$_{0.5}$ have been predicted by several calculations and then confirmed by high-resolution photoemission and scanning tunneling experiments. However, so far, the shreds of the electrical transport evidence for topological surface states are still in absence. By carrying out electrical transport experiments, we observe a topological transition with a nonlinear Hall conductivity and simultaneous linear magnetoresistance near the superconducting transition temperature. Furthermore, we observe a sign reversal of the Hall coefficient accompanied by a concurrently softening of the ${A}_{1g}$ phonon mode at about 40 K, indicating a nematic transition. The synchronized phonon softening with nematicity manifests an enhanced fluctuation state through spin-phonon interaction. Our results solidly corroborate the topological surface states of FeTe$_{0.5}$Se$_{0.5}$ and provide an understanding of the mechanism of the superconductivity in iron chalcogenides.
2209.03267v2
2022-09-14
Structural peculiarities of $\varepsilon$-Fe$_2$O$_3$ / GaN epitaxial layers unveiled by high-resolution transmission electron microscopy and neutron reflectometry
The present paper is dedicated to the structural study of crystallographic peculiarities appearing in epitaxial films of metastable epsilon iron oxide ($\varepsilon$-Fe$_2$O$_3$) grown by pulsed laser deposition onto a semiconductor GaN (0001) substrate. The columnar structure of the nanoscale $\varepsilon$-Fe$_2$O$_3$ films has been for the first time investigated using high resolution electron microscopy (HRTEM) direct space technique complemented by reciprocal space methods of high-energy electron diffraction and color-enhanced HRTEM image Fourier filtering. The study of $\varepsilon$-Fe$_2$O$_3$ / GaN interface formation has been further expanded by carrying out a depth resolved analysis of density and chemical composition by neutron reflectometry and energy-dispersive X-ray spectroscopy. The obtained results shed light onto the properties and the origin of the enigmatic few-nanometer thick low density transition layer residing at the $\varepsilon$-Fe$_2$O$_3$ / GaN interface. A detailed knowledge of the properties of this layer is believed to be highly important for the development of $\varepsilon$-Fe$_2$O$_3$ / GaN heterostructures that can potentially become part of the iron-oxide based ferroic-on-semiconductor devices with room temperature magneto-electric coupling.
2209.06460v1
2022-09-15
Spin-charge coupling and decoupling in perovskite-type iron oxides (Sr$_{1-x}$Ba$_x$)$_{2/3}$La$_{1/3}$FeO$_3$
The perovskite-type iron oxide Sr$_{2/3}$La$_{1/3}$FeO$_3$ is known to show characteristic spin-charge ordering (SCO), where sixfold collinear spin ordering and threefold charge ordering are coupled with each other. Here, we report the discovery of a spin-charge decoupling and an antiferromagnetic (AFM) state competing with the SCO phase in perovskites (Sr$_{1-x}$Ba$_x$)$_{2/3}$La$_{1/3}$FeO$_3$. By comprehensive measurements including neutron diffraction, M$\"{o}$ssbauer spectroscopy, and x-ray absorption spectroscopy, we found that the isovalent Ba$^{2+}$ substitution systematically reduces the critical temperature of the SCO phase and additionally yields the spin-charge decoupling in $x$ > 0.75. Whereas the ground state remains in the SCO phase in the whole $x$ region, an unexpected G-type AFM phase with incoherent charge ordering or charge fluctuation appears as the high-temperature phase in the range of $x$ > 0.75. Reflecting the competing nature between them, the G-type AFM phase partially exists as a metastable state in the SCO phase at low temperatures. We discuss the origin of the spin-charge decoupling and the emergence of the G-type AFM phase with charge fluctuation in terms of the bandwidth reduction by the Ba substitution.
2209.07310v1
2022-09-18
Revisit the Circumnuclear X-ray Emission of NGC 2992 in a Historically Low State
The inner-most region of the Seyfert galaxy NGC 2992 has long been suspected to be the location of intense AGN-host galaxy interaction, but photon pile-up in previous high-resolution observations hampered the study of soft X-ray excess and the interaction near its nucleus. We present an X-ray imaging spectroscopic analysis of the circumnuclear ($1^{\prime\prime}$--$3^{\prime\prime}$) region of NGC 2992 using the zeroth-order image of a 135 ks grating observation obtained with Chandra, which captured the nucleus in a historically low flux state. Extended soft X-ray emission is detected in the circumnuclear region with observed luminosity $L_{\rm X} \sim 7 \times 10^{39}\rm\ erg\ s^{-1}$. The majority of previously puzzling detection of soft excess could be associated with the outflow, indicated by the morphological correspondences between soft X-ray emission and figure-eight-shaped radio bubbles. An anomalous narrow emission line with the centroid energy $\sim4.97$ keV is found. If attributed to redshifted highly ionized iron emission (e.g., Fe xxv), the required outflow velocity is $\sim0.23\,c$. An alternative explanation is that this line emission could be produced by the nuclear spallation of iron. We also find asymmetric extended Fe K$\alpha$ emission along the galactic disk, which could originate from reflection by cold gas on $\sim 200$ pc scale.
2209.08534v1
2022-09-18
Efficient photocatalytic nitrogen fixation from air under sunlight via iron-doped WO$_3$
Photocatalytic nitrogen fixation from air directly under sunlight can contribute significantly to carbon neutralization. It is an ideal pathway to replace the industrial Haber Bosch process in future. A Fe-doped layered WO$_3$ photocatalyst containing oxygen vacancies was developed which can fix nitrogen from air directly under sunlight at atmospheric pressure. The iron doping enhances the transport efficiency of photogenerated electrons. The photocatalytic efficiency is around 4 times higher than that of pure WO$_3$. The optimum nitrogen fixation conditions were examined by orthogonal experiments and its nitrogen fixation performance could reach up to 477 $\mu \text{g} \cdot \text{g}_{\text{cat}}^{-1} \cdot \text{h}^{-1}$ under sunlight. In addition, the process of nitrogen fixation was detected by situ infrared, which confirmed the reliability of nitrogen fixation. Also, modelling on the interactions between light and the photocatalyst was carried out to study the distribution of surface charge and validate the light absorption of the photocatalyst. This work provides a simple and cheap strategy for photocatalytic nitrogen fixation from air under mild conditions.
2209.08547v1
2022-09-30
Charge Transport in Ba$_{1-x}$Rb$_{x}$Fe$_{2}$As$_{2}$ Single Crystals
Recent studies in heavily hole-doped iron-based superconductor RbFe$_2$As$_2$ have suggested the emergence of novel electronic nematicity directed along the Fe-As direction, 45$^\circ$ rotated from the usual nematicity ubiquitously found in BaFe$_2$As$_2$ and related materials. This motivates us to study the physical properties of Ba$_{1-x}$Rb$_{x}$Fe$_{2}$As$_{2}$, details of which remain largely unexplored. Here we report on the normal-state charge transport in Ba$_{1-x}$Rb$_{x}$Fe$_{2}$As$_{2}$ superconductors by using high-quality single crystals in the range of Rb concentration $0.14\le x \le 1.00$. From the systematic measurements of the temperature dependence of electrical resistivity $\rho(T)$, we find a signature of a deviation from the Fermi liquid behavior around the optimal composition, which does not seem related to the antiferromagnetic quantum criticality but has a potential link to hidden nematic quantum criticality. In addition, electron correlations derived from the coefficient of $T^2$ resistivity show a marked increase with Rb content near the heavily hole-doped end, consistent with the putative Mott physics near the $3d^5$ electron configuration in iron-based superconductors.
2209.15526v1
2022-10-20
Kinetics of transformation, border of metastable miscibility gap in Fe-Cr alloy and limit of Cr solubility in iron at 858 K
The study was aimed at determination of the position of the Fe-rich border of the metastable miscibility gap (MMG) and of the solubility limit of Cr in iron at 858 K. Towards this end a Fe73.7Cr26.3 alloy was isothermally annealed at 858 K in vacuum up to 8144 hours and M\"ossbauer spectra were recorded at room temperature after every step of the annealing. Three spectral parameters viz. the average hyperfine field, <B>, the average isomer shift, <IS>, and the probability of the atomic configuration with no Cr atoms in the two-shell vicinity of the probe Fe atoms, P(0,0), gave evidence that the transformation process takes place in two stages. All three parameters could have been well described in terms of the Johnson-Mehl-Avrami-Kolmogorov equation, yielding kinetics parameters. The first stage, associated with the phase decomposition, proceeded much faster than the second stage, associated with the alpha-to-sigma phase transformation. The most reliable estimation of the position of the MMG and that of the value of the Cr solubility limit was obtained from the annealing time dependence of <B>, namely 24.5 at.% Cr for the former and 20.3 at.% Cr for the latter. A comparison of these figures with the recent phase diagrams pertinent to Fe-Cr system was done.
2210.11550v1
2022-11-04
Unusual Abundances from Planetary System Material Polluting the White Dwarf G238-44
Ultraviolet and optical spectra of the hydrogen-dominated atmosphere white dwarf star G238-44 obtained with FUSE, Keck/HIRES, HST/COS, and HST/STIS reveal ten elements heavier than helium: C, N, O, Mg, Al, Si, P, S, Ca, and Fe. G238-44 is only the third white dwarf with nitrogen detected in its atmosphere from polluting planetary system material. Keck/HIRES data taken on eleven nights over 24 years show no evidence for variation in the equivalent width of measured absorption lines, suggesting stable and continuous accretion from a circumstellar reservoir. From measured abundances and limits on other elements we find an anomalous abundance pattern and evidence for the presence of metallic iron. If the pollution is from a single parent body, then it would have no known counterpart within the solar system. If we allow for two distinct parent bodies, then we can reproduce the observed abundances with a mix of iron-rich Mercury-like material and an analog of an icy Kuiper Belt object with a respective mass ratio of 1.7:1. Such compositionally disparate objects would provide chemical evidence for both rocky and icy bodies in an exoplanetary system and would be indicative of a planetary system so strongly perturbed that G238-44 is able to capture both asteroid- and Kuiper Belt-analog bodies near-simultaneously within its $<$100 Myr cooling age.
2211.02673v1
2022-11-09
Asynchronous accretion can mimic diverse white dwarf pollutants I: core and mantle fragments
Polluted white dwarfs serve as astrophysical mass spectrometers - their photospheric abundances are used to infer the composition of planetary objects that accrete onto them. We show that due to asymmetries in the accretion process, the composition of the material falling onto a star may vary with time during the accretion of a single planetary body. Consequently, the instantaneous photospheric abundances of white dwarfs do not necessarily reflect the bulk composition of their pollutants, especially when their diffusion timescales are short. In particular, we predict that when an asteroid with an iron core tidally disrupts around a white dwarf, a larger share of its mantle is ejected, and that the core/mantle fraction of the accreting material varies with time during the event. Crucially, this implies that the core fraction of differentiated pollutants cannot be determined for white dwarfs with short diffusion timescales, which sample only brief episodes of longer accretion processes. The observed population of polluted white dwarfs backs up the proposed theory. More white dwarfs have accreted material with high Fe/Ca than low Fe/Ca relative to stellar abundance ratios, indicating the ejection of mantle material. Additionally, we find tentative evidence that the accretion rate of iron decreases more rapidly than that of magnesium or calcium, hinting at variability of the accreted composition. Further corroboration of the proposed theory will come from the up-coming analysis of large samples of young white dwarfs.
2211.05114v1
2022-11-21
Discontinuous Shear Thickening (DST) transition with spherical iron particles coated by adsorbed brush polymer
In this work we explore the rheology of very concentrated (0.55<$\Phi$<0.67) suspensions of carbonyl iron (CI) particles coated by a small polymer. A strong DST is observed in a large range of volume fraction presenting some specificities relatively to other systems. In particular, in a given range of volume fraction, the DST transition appears suddenly without being preceded by shear thickening. The presence of a frictional network of particles is confirmed by a simultaneous measurement of the electric resistance of the suspension and of the rheological curve. Using the Wyart-Cates model we show that, increasing the volume fraction, the fraction of frictional contacts grows more and more quickly with the stress that disagrees with the prediction of computer simulations. The same kind of behavior is observed in the presence of a magnetic field with, in addition, a very strong increase of the viscosity with the magnetic field before the transition. We interpret this behavior by the interpenetration of the polymer layer under the effect of the shear stress-and of the magnetic stress-followed by the expulsion of the polymer out of the surfaces. Besides we point that, above the DST transition, we do not observe a jamming in the range of volume fraction whereas it is predicted by the W-C model. Based on the fact that in the absence of shear flow, the polymer should come back to the surface and destroy the frictional contacts we can predict an asymptotic non-zero shear rate and reproduce the experimental behavior.
2211.11807v1
2022-12-03
Electron correlation in the Iron(II) Porphyrin by NOF approximations
The relative stability of the singlet, triplet, and quintet spin states of Iron(II) porphyrin (FeP) represents a challenging problem for electronic structure methods. While it is currently accepted that the ground state is a triplet, multiconfigurational wavefunction-based methods predict a quintet, and density functional approximations vary between triplet and quintet states, leading to a prediction that highly depends on the features of the method employed. The recently proposed Global Natural Orbital Functional (GNOF) aims to provide a balanced treatment between static and dynamic correlation, and together with the previous Piris Natural Orbital Functionals (PNOFs), allowed us to explore the importance of each type of correlation in the stability order of the states of FeP with a method that conserves the spin of the system. It is noteworthy that GNOF correlates all electrons in all available orbitals for a given basis set; in the case of the FeP with a double zeta basis set as used in this work; this means that GNOF can properly correlate 186 electrons in 465 orbitals, significantly increasing the sizes of systems amenable to multiconfigurational treatment. Results show that PNOF5, PNOF7s and PNOF7 predict the quintet to have a lower energy than the triplet state; however, the addition of dynamic correlation via second-order Moller-Plesset corrections (NOF-MP2) turns the triplet state to be lower than the quintet state, a prediction also reproduced by GNOF that incorporates much more dynamic correlation than its predecessors.
2212.01640v1
2022-12-13
Collapse of Metallicity and High-$T_c$ Superconductivity in the High-Pressure phase of FeSe$_{0.89}$S$_{0.11}$
We investigate the high-pressure phase of the iron-based superconductor FeSe$_{0.89}$S$_{0.11}$ using transport and tunnel diode oscillator studies. We construct detailed pressure-temperature phase diagrams that indicate that outside of the nematic phase, the superconducting critical temperature reaches a minimum before it is quickly enhanced towards 40 K above 4 GPa. The resistivity data reveal signatures of a fan-like structure of non-Fermi liquid behaviour which could indicate the existence of a putative quantum critical point buried underneath the superconducting dome around 4.3 GPa. Further increasing the pressure, the zero-field electrical resistivity develops a non-metallic temperature dependence and the superconducting transition broadens significantly. Eventually, the system fails to reach a fully zero-resistance state despite a continuous finite superconducting transition temperature, and any remaining resistance at low temperatures becomes strongly current-dependent. Our results suggest that the high-pressure, high-$T_c$ phase of iron chalcogenides is very fragile and sensitive to uniaxial effects of the pressure medium, cell design and sample thickness which can trigger a first-order transition. These high-pressure regions could be understood assuming a real-space phase separation caused by concomitant electronic and structural instabilities.
2212.06824v1
2022-12-21
Post-Synthetic Treatment of Nickel-Iron Layered Double Hydroxides for the Optimum Catalysis of the Oxygen Evolution Reaction
Nickel-iron layered double hydroxide (NiFe LDH) platelets with high morphological regularity and sub-micrometre lateral dimensions were synthesized using a homogeneous precipitation technique for highly efficient catalysis of the oxygen evolution reaction (OER). Considering edge sites are the point of activity, efforts were made to control platelet size within the synthesized dispersions. The goal is to controllably isolate and characterize size-reduced NiFe LDH particles. Synthetic approaches for size control of NiFe LDH platelets have not been transferable based on published work with other LDH materials and for that reason, we instead use post-synthetic treatment techniques to improve edge-site density. In the end, size reduced NiFe LDH/single-wall carbon nanotube (SWCNT) composites allowed to further reduce the OER overpotential to 237 plus/minus 7 mV ( L = 0.16 plus/minus 0.01 micrometres, 20 wt% SWCNT), which is one of the best values reported to date. This approach as well improved the long term activity of the catalyst in operating conditions.
2212.11378v1
2023-01-03
Extracting optical parameters of Cu-Mn-Fe spinel oxide nanoparticles for optimizing air-stable, high-efficiency solar selective coatings
High-temperature Cu-Mn-Fe spinel-oxide nanoparticle solar selective absorber coatings are investigated experimentally and theoretically. A reliable, general approach to evaluate absorption coefficient spectra from the optical measurements of the nanoparticle-pigmented coatings is developed based on solving the inverse problem using four-flux-radiative method. The derived absorption properties of NP materials can be directly applied to predict the solar absorptance, optimize the nanoparticle-pigmented coatings, and analyze the thermal degradation, which agree well with the experimental results. The analysis reveals that the Cu-Mn-Fe spinel oxides are fundamentally indirect bandgap ranging from 1.7 to 2.1 eV, while iron-free CuMn2O4 is a direct bandgap material with Eg=1.84 eV. With the same coating thickness and nanoparticle load, the solar absorptance ranks in the order of Mn2O3 < MnFe2O4 < CuFe2O4 < CuFeMnO4 < CuMn2O4. The optimized spray-coated iron-free CuMn2O4 NP-pigmented coating demonstrates a high solar absorptance of 97%, a low emittance of 55%, a high optical-to-thermal energy conversion efficiency of ~93.5 % under 1000x solar concentration at 750 degrees C, and long-term endurance upon thermal cycling between 750{\deg}C and room temperature in air. The optical parameter analysis approach can be easily extended to other material systems to facilitate the searching and optimizing high-temperature pigmented-solar selective coatings.
2301.01194v1
2023-01-07
Orthogonal magnetic structures of Fe4O5:representation analysis and DFT calculations
The magnetic and electronic structures of Fe4O5 have been investigated at ambient and high pressures via a combination of representation analysis, density functional theory (DFT+U) calculations, and M\"ossbauer spectroscopy. A few spin configurations corresponding to the different irreducible representations have been considered. The total-energy calculations reveal that the magnetic ground state of Fe4O5 corresponds to an orthogonal spin order. Depending on the magnetic propagation vector k two spin ordered phases with minimal energy differences are realized. The lowest energy magnetic phase is related to k = (0, 0, 0) and is characterized by the ferromagnetic ordering of the iron magnetic moments at prismatic sites along the b axis and antiferromagnetic ordering of iron moments at octahedral sites along the c axis. For the k = (1/2, 0, 0) phase, the moments in the prisms are antiferromagnetically ordered along the b axis and the moments in the octahedra are still antiferromagnetically ordered along the c axis. Under high pressure, the Fe4O5 exhibits magnetic transitions with corresponding electronic transitions of the metal-insulator type. At a critical pressure PC ~ 60 GPa the Fe ions at the octahedral sites undergo a high-spin to low-spin state crossover with a decrease in the unit-cell volume of ~ 4%, while the Fe ions at the prismatic sites remain in the high-spin state up to 130 GPa. This site-dependent magnetic collapse is experimentally observed in the transformation of M\"ossbauer spectra measured at room temperature and high pressures.
2301.02824v1
2023-02-03
An empirical relation to estimate host galaxy stellar light from AGN spectra
Measurement of black hole mass for low-$z$ ($z\leq 0.8$) Active Galactic Nuclei (AGNs) is difficult due to the strong contribution from host galaxy stellar light necessitating detailed spectral decomposition to estimate the AGN luminosity. Here, we present an empirical relation to estimate host galaxy stellar luminosity from the optical spectra of AGNs at $z\leq 0.8$. The spectral data were selected from the fourteenth data release of the Sloan Digital Sky Survey (SDSS-DR14) quasar catalog having a signal-to-noise ratio at 5100 \AA (SNR$_{5100}$) $>$10 containing 11415 quasars. The median total luminosity (log ($L_\text{total}$/[erg s$^{-1}$])), stellar luminosity (log ($L_\text{star}$/[erg s$^{-1}$])), and AGN continuum luminosity (log ($L_\text{cont}$/[erg s$^{-1}$])) in our sample are 44.52, 44.06, and 44.30, respectively. We fit the AGN power-law continuum, host galaxy, and iron blend contribution, simultaneously over the entire available spectrum. We found the host galaxy fraction to anti-correlate with continuum luminosity and can be well-represented by a polynomial function, which can be used to correct the stellar light contribution from AGN spectra. We also found anti-correlation between host galaxy fraction and iron strength, Eddington ratio, and redshift. The empirical relation gives comparable results of host-fraction with the image decomposition method.
2302.01948v2
2023-02-13
Evolution of phase morphology in dispersed clay systems under the microwave irradiation
The results of a study of the effect of microvolume emission (power 700 W, frequency 2.45 GHz) on the structural changes in natural clay particles are presented. The influence of the irradiation time (10 and 20 minutes) and the environment in the microwave chamber (atmospheric air and air saturated with water vapor) on the structural changes occurring in the particles was traced. During the first 10 minutes, capillary water is completely removed and agglomeration is carried out by attaching single dispersed particles (diffusion limited aggregation model). At the second stage (10-20 minutes), already formed agglomerates (cluster-cluster aggregation model) are growing. A complex of independent optical-physical methods was used to analyze weak structural changes. It includes X-ray phase analysis, colorimetry and wavelet analysis. This approach has made it possible to increase the information content and reliability of measurements, quantitatively characterize the structural responses in disperse clay systems. In the air, the removal of capillary water is accompanied by agglomerations of particles and polymorphic transformations of oxides: montmorillonite is completely decomposed, amorphous phases crystallize. The composition of the environment in the microwave chamber affects the type of phase transformations in iron compounds: iron-alumina is formed in air, magnetite appear in the water vapor medium. The studies carried out using the developed set of experimental methods indicate the possibility of regulating the processes of structure formation in disperse clay systems by optimizing the regimes of exposure to microwave radiation.
2302.06330v1
2023-03-01
A Search for Chemical Anomalies of Seven A-types Stars
We present a chemical abundance analysis of seven A-type stars with no detailed chemical abundance measurements in the literature. High-resolution spectra of the targets HD 2924, HD 4321, HD 26553, HD 125658, HD 137928, HD 154713, and HD 159834 were obtained using the Coude Echelle Spectrograph at the TUBITAK National Observatory. We determined the atmospheric abundances of the samples and measured the elemental abundances of C, N, O, Na, Mg, Al, Si, S, K, Ca, Sc, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Zn, Sr, Y, Zr, Ba, La, Ce, Nd, Sm, Eu, and Gd. The masses of the stars were estimated based on their evolutionary tracks, and their ages were calculated using isochrones. We also calculated the radii of the stars. The abundance patterns of HD 4321, HD 125658, and HD 154713 were found to be in agreement with those of classical Am stars, with underabundant Ca and Sc, overabundant heavier elements, and moderate overabundance of iron-peak elements. We found that HD 137928 and HD 159834 have similar abundance characteristics to marginal Am-type stars. The elemental distributions of HD 2924 and HD 26553 are consistent with the pattern of normal A-type stars. The iron, nickel, and zinc abundances of HD 125658 and HD 137928 are significantly higher than other Am stars. These values suggest that they are among the most metal-rich Am stars
2303.00584v1
2023-05-29
Intertwined charge and pair density orders in a monolayer high-Tc iron-based superconductor
Symmetry-breaking electronic phase in unconventional high-temperature (high-Tc) superconductors is a fascinating issue in condensed-matter physics, among which the most attractive phases are charge density wave (CDW) phase with four unit-cell periodicity in cuprates and nematic phase breaking the C4 rotational symmetry in iron-based superconductors (FeSCs). Recently, pair density wave (PDW), an exotic superconducting phase with non-zero momentum Cooper pairs, has been observed in high-Tc cuprates and the monolayer FeSC. However, the interplay between the CDW, PDW and nematic phase remains to be explored. Here, using scanning tunneling microscopy/spectroscopy, we detected commensurate CDW and CDW-induced PDW orders with the same period of lambda = 4aFe (aFe is the distance between neighboring Fe atoms) in a monolayer high-Tc Fe(Te,Se) film grown on SrTiO3(001) substrate. Further analyses demonstrate the observed CDW is a smectic order, which breaks both translation and C4 rotational symmetry. Moreover, the smecticity of the CDW order is strongest near the superconducting gap but weakens near defects and in an applied magnetic field, indicating the interplay between the smectic CDW and PDW orders. Our works provide a new platform to study the intertwined orders and their interactions in high-Tc superconductors.
2305.17991v1
2023-06-22
Type Ia Supernova Nucleosynthesis: Metallicity-Dependent Yields
Type Ia supernova explosions (SNIa) are fundamental sources of elements for the chemical evolution of galaxies. They efficiently produce intermediate-mass (with Z between 11 and 20) and iron group elements - for example, about 70% of the solar iron is expected to be made by SNIa. In this work, we calculate complete abundance yields for 39 models of SNIa explosions, based on three progenitors - a 1.4M deflagration detonation model, a 1.0 double detonation model and a 0.8 M double detonation model - and 13 metallicities, with 22Ne mass fractions of 0, 1x10-7, 1x10-6, 1x10-5, 1x10-4, 1x10-3, 2x10-3, 5x10-3, 1x10-2, 1.4x10-2, 5x10-2, and 0.1 respectively. Nucleosynthesis calculations are done using the NuGrid suite of codes, using a consistent nuclear reaction network between the models. Complete tables with yields and production factors are provided online at Zenodo: Yields. We discuss the main properties of our yields in the light of the present understanding of SNIa nucleosynthesis, depending on different progenitor mass and composition. Finally, we compare our results with a number of relevant models from the literature.
2306.12885v1
2023-06-27
Permanent magnet systems to study the interaction between magnetic nanoparticles and cells in microslide channels
We optimized designs of permanent magnet systems to study the effect of magnetic nanoparticles on cell cultures in microslide channels. This produced two designs, one of which is based on a large cylindrical magnet that applies a uniform force density of 6 MN/m$^3$ on soft magnetic iron-oxide spherical nanoparticles at a field strength of over 300 mT. We achieved a force uniformity of better than 14% over the channel area leading to a concentration variation that was below our measurement resolution. The second design was aimed at maximizing the force by using a Halbach array. We indeed increased the force by more than one order of magnitude at force density values over 400 MN/m$^3$, but at the cost of uniformity. However, the latter system can be used to trap magnetic nanoparticles efficiently and to create concentration gradients. We demonstrated both designs by analyzing the effect of magnetic forces on the cell viability of human hepatoma HepG2 cells in the presence of bare Fe$_2$O$_3$ and cross-linked dextran iron-oxide cluster-type particles (MicroMod). Python scripts for magnetic force calculations and particle trajectory modeling as well as source files for 3D prints have been made available so these designs can be easily adapted and optimized for other geometries.
2306.15459v2
2023-07-10
Design and processing as ultrathin films of a sublimable Iron(II) spin crossover material exhibiting efficient and fast light-induced spin transition
Materials based on spin crossover (SCO) molecules have centred the attention in Molecular Magnetism for more than forty years as they provide unique examples of multifunctional and stimuli-responsive materials, which can be then integrated into electronic devices to exploit their molecular bistability. This process often requires the preparation of thermally stable SCO molecules that can sublime and remain intact in contact with surfaces. However, the number of robust sublimable SCO molecules is still very scarce. Here we report a novel example of this kind. It is based on a neutral iron (II) coordination complex formulated as [FeII(neoim)2], where neoimH is the ionogenic ligand 2-(1H-imidazol-2-yl)-9-methyl-1,10-phenanthroline. In the first part a comprehensive study, which covers the synthesis and magneto-structural characterization of the [FeII(neoim)2] complex as a bulk microcrystalline material, is reported. Then, in the second part we investigate the suitability of this material to form thin films through high vacuum (HV) sublimation. Finally, the retainment of all present SCO capabilities in the bulk when the material is processed is thoroughly studied by means of X-ray absorption spectroscopy. In particular, a very efficient and fast light-induced spin transition (LIESST effect) has been observed, even for ultrathin films of 15 nm.
2307.04591v1
2023-07-17
Controlling the Temperature of the Spin-Reorientation Transition In HoFe1-xMnxO3 Orthoferrite Single Crystals
HoFe1-xMnxO3 (0 < x < 1) single crystals have been grown by the optical floating zone technique. A structural transition from the orthorhombic to hexagonal modification has been established in the crystals in the concentration range of 0.7-0.8, which has been confirmed by the X-ray diffraction data. For a series of the rhombic crystals, the room-temperature Mossbauer study and magnetic measurements in the temperature range of 4.2-1000 K have been carried out. It has been observed that, with an increase in the manganese content in the samples, the temperature of the spin-reorientation transition increases significantly: from 60 K in the HoFeO3 compound to room temperature in HoFe0.6Mn0.4O3. The magnetic measurements have shown that, upon substitution of manganese for iron, the magnetic orientational type transition changes from a second-order transition (AxFyGz -> CxGyFz) to first-order one (AxFyGz -> GxCyAz) with a weak ferromagnetic moment only in the b direction (for Pnma notation). The growth of the spin-reorientation transition temperature has been attributed to the change in the value of the indirect exchange in the iron subsystem under the action of manganese, which has been found when studying the Mossbauer effect in the HoFe1-xMnxO3 (x < 0.4) compound.
2307.08236v1
2023-07-19
Origin of Life Molecules in the Atmosphere After Big Impacts on the Early Earth
The origin of life on Earth would benefit from a prebiotic atmosphere that produced nitriles, like HCN, which enable ribonucleotide synthesis. However, geochemical evidence suggests that Hadean air was relatively oxidizing with negligible photochemical production of prebiotic molecules. These paradoxes are resolved by iron-rich asteroid impacts that transiently reduced the entire atmosphere, allowing nitriles to form in subsequent photochemistry. Here, we investigate impact-generated reducing atmospheres using new time-dependent, coupled atmospheric chemistry and climate models, which account for gas-phase reactions and surface-catalysis. The resulting H$_2$-, CH$_4$- and NH$_3$-rich atmospheres persist for millions of years, until hydrogen escapes to space. HCN and HCCCN production and rainout to the surface can reach $10^9$ molecules cm$^{-2}$ s$^{-1}$ in hazy atmospheres with a mole ratio of $\mathrm{CH_4} / \mathrm{CO_2} > 0.1$. Smaller $\mathrm{CH_4} / \mathrm{CO_2}$ ratios produce HCN rainout rates $< 10^5$ molecules cm$^{-2}$ s$^{-1}$, and negligible HCCCN. The minimum impactor mass that creates atmospheric $\mathrm{CH_4} / \mathrm{CO_2} > 0.1$ is $4 \times 10^{20}$ to $5 \times 10^{21}$ kg (570 to 1330 km diameter), depending on how efficiently iron reacts with a steam atmosphere, the extent of atmospheric equilibration with an impact-induced melt pond, and the surface area of nickel that catalyzes CH$_4$ production. Alternatively, if steam permeates and deeply oxidizes crust, impactors $\sim 10^{20}$ kg could be effective. Atmospheres with copious nitriles have $> 360$ K surface temperatures, perhaps posing a challenge for RNA longevity, although cloud albedo can produce cooler climates. Regardless, post-impact cyanide can be stockpiled and used in prebiotic schemes after hydrogen has escaped to space.
2307.09761v1
2023-07-28
Structural phase transition, $s_{\pm}$-wave pairing and magnetic stripe order in the bilayered nickelate superconductor La$_3$Ni$_2$O$_7$ under pressure
Motivated by the recently discovered high-$T_c$ superconductor La$_3$Ni$_2$O$_7$, we comprehensively study this system using density functional theory and random phase approximation calculations. At low pressures, the Amam phase is stable, containing the Y$^{2-}$ mode distortion from the Fmmm phase, while the Fmmm phase is unstable. Because of small differences in enthalpy and a considerable Y$^{2-}$ mode amplitude, the two phases may coexist in the range between 10.6 and 14 GPa, beyond which the Fmmm phase dominates. In addition, the magnetic stripe-type spin order with wavevector ($\pi$, 0) was stable at the intermediate region. Pairing is induced in the $s_{\pm}$-wave channel due to partial nesting between the {\bf M}=$(\pi, \pi)$ centered pockets and portions of the Fermi surface centered at the {\bf X}=$(\pi, 0)$ and {\bf Y}=$(0, \pi)$ points. This resembles results for iron-based superconductors but has a fundamental difference with iron pnictides and selenides. Moreover, our present efforts also suggest that La$_3$Ni$_2$O$_7$ is qualitatively different from infinite-layer nickelates and cuprate superconductors.
2307.15276v4
2023-08-01
The current state of disk wind observations in BHLMXBs through X-ray absorption lines in the iron band
The presence of blueshifted absorption lines in the X-ray spectra of Black Hole Low Mass X-ray Binaries is the telltale of massive outflows called winds. These signatures are found almost exclusively in soft states of high-inclined systems, hinting at equatorial ejections originating from the accretion disk and deeply intertwined with the evolution of the outburst patterns displayed by these systems. In the wake of the launch of the new generation of X-ray spectrometers, studies of wind signatures remain mostly restricted to single sources and outbursts, with some of the recent detections departing from the commonly expected behaviors. We thus give an update to the current state of iron band absorption lines detections, through the analysis of all publicly available XMM-$Newton$-PN and $Chandra$-HETG exposures of known Black Hole Low-Mass X-ray Binary candidates. Our results agree with previous studies, with wind detections exclusively found in dipping, high-inclined sources, and almost exclusively in bright ($L_{X}>0.01L_{Edd}$) soft ($HR<0.8$) states, with blueshift values generally restricted to few 100 km s$^{-1}$. The line parameters indicate similar properties between objects and outbursts of single sources, and despite more than 20 years of data, very few sources have the HID sampling necessary to properly study the evolution of the wind during single outbursts. We provide an online tool with details of the wind signatures and outburst evolution data for all sources in the sample.
2308.00691v1
2023-08-07
Energy-resolved pulse profiles of accreting pulsars: Diagnostic tools for spectral features
We introduce a method for extracting spectral information from energy-resolved light curves folded at the neutron star spin period (known as pulse profiles) in accreting X-ray binaries. Spectra of these sources are sometimes characterized by features superimposed on a smooth continuum, such as iron emission lines and cyclotron resonant scattering features. We address here the question on how to derive quantitative constraints on such features from energy-dependent changes in the pulse profiles. We developed a robust method for determining in each energy-selected bin the value of the pulsed fraction using the fast Fourier transform opportunely truncated at the number of harmonics needed to satisfactorily describe the actual profile. We determined the uncertainty on this value by sampling through Monte Carlo simulations a total of 1000 faked profiles. We rebinned the energy-resolved pulse profiles to have a constant minimum signal-to-noise ratio throughout the whole energy band. Finally we characterize the dependence of the energy-resolved pulsed fraction using a phenomenological polynomial model and search for features corresponding to spectral signatures of iron emission or cyclotron lines using Gaussian line profiles. We apply our method to a representative sample of NuSTAR observations of well-known accreting X-ray pulsars. We show that, with this method, it is possible to characterize the pulsed fraction spectra, and to constrain the position and widths of such features with a precision comparable with the spectral results. We also explore how harmonic decomposition, correlation, and lag spectra might be used as additional probes for detection and characterization of such features.
2308.03395v1
2023-08-08
Designing optoelectronic properties by on-surface synthesis: formation and electronic structure of an iron-terpyridine macromolecular complex
Supramolecular chemistry protocols applied on surfaces offer compelling avenues for atomic scale control over organic-inorganic interface structures. In this approach, adsorbate-surface interactions and two-dimensional confinement can lead to morphologies and properties that differ dramatically from those achieved via conventional synthetic approaches. Here, we describe the bottom-up, on-surface synthesis of one-dimensional coordination nanostructures based on an iron (Fe)-terpyridine (tpy) interaction borrowed from functional metal-organic complexes used in photovoltaic and catalytic applications. Thermally activated diffusion of sequentially deposited ligands and metal atoms, and intra-ligand conformational changes, lead to Fe-tpy coordination and formation of these nanochains. Low-temperature Scanning Tunneling Microscopy and Density Functional Theory were used to elucidate the atomic-scale morphology of the system, providing evidence of a linear tri-Fe linkage between facing, coplanar tpy groups. Scanning Tunneling Spectroscopy reveals highest occupied orbitals with dominant contributions from states located at the Fe node, and ligand states that mostly contribute to the lowest unoccupied orbitals. This electronic structure yields potential for hosting photo-induced metal-to-ligand charge transfer in the visible/near-infrared. The formation of this unusual tpy/tri-Fe/tpy coordination motif has not been observed for wet chemistry synthesis methods, and is mediated by the bottom-up on-surface approach used here.
2308.04105v1
2023-09-05
Magnetic and structural properties of the iron silicide superconductor LaFeSiH
The magnetic and structural properties of the recently discovered pnictogen/chalcogen-free superconductor LaFeSiH ($T_c\simeq10$~K) have been investigated by $^{57}$Fe synchrotron M{\"o}ssbauer source (SMS) spectroscopy, x-ray and neutron powder diffraction and $^{29}$Si nuclear magnetic resonance spectroscopy (NMR). No sign of long range magnetic order or local moments has been detected in any of the measurements and LaFeSiH remains tetragonal down to 2 K. The activated temperature dependence of both the NMR Knight shift and the relaxation rate $1/T_1$ is analogous to that observed in strongly overdoped Fe-based superconductors. These results, together with the temperature-independent NMR linewidth, show that LaFeSiH is an homogeneous metal, far from any magnetic or nematic instability, and with similar Fermi surface properties as strongly overdoped iron pnictides. This raises the prospect of enhancing the $T_c$ of LaFeSiH by reducing its carrier concentration through appropriate chemical substitutions. Additional SMS spectroscopy measurements under hydrostatic pressure up to 18.8~GPa found no measurable hyperfine field.
2309.02241v1
2023-09-15
Superconductivity and vortex structure on Bi$_{2}$Te$_{3}$/FeTe$_{0.55}$Se$_{0.45}$ heterostructures with different thickness of Bi$_{2}$Te$_{3}$ films
Using scanning tunnel microscopy (STM), we investigate the superconductivity and vortex properties in topological insulator Bi$_{2}$Te$_{3}$ thin films grown on the iron-based superconductor FeTe$_{0.55}$Se$_{0.45}$. The proximity-induced superconductivity weakens in the Bi$_{2}$Te$_{3}$ film when the thickness of the film increases. Unlike the elongated shape of vortex cores observed in the Bi$_{2}$Te$_{3}$ film with 2-quintuple-layer (QL) thickness, the isolated vortex cores exhibit a star shape with six rays in the 1-QL film, and the rays are along the crystalline axes of the film. This is consistent with the sixfold rotational symmetry of the film lattice, and the proximity-induced superconductivity is still topologically trivial in the 1-QL film. At a high magnetic field, when the direction between the two nearest neighbored vortices deviates from that of any crystalline axes, two cores connect each other by a pair of adjacent rays, forming a new type of electronic structure of vortex cores. On the 3-QL film, the vortex cores elongate along one of the crystalline axes of the Bi$_{2}$Te$_{3}$ film, similar to the results obtained on 2-QL films. The elongated vortex cores indicate a twofold symmetry of the superconducting gap induced by topological superconductivity with odd parity. This observation confirms possible topological superconductivity in heterostructures with a thickness of more than 2 QLs. Our results provide rich information for the vortex cores and vortex-bound states on the heterostructures consisting of the topological insulator and the iron-based superconductor.
2309.08246v1
2023-09-22
Wavelet spectral timing: X-ray reverberation from a dynamic black hole corona hidden beneath ultrafast outflows
Spectral timing analyses based upon wavelet transforms provide a new means to study the variability of the X-ray emission from accreting systems, including AGN, stellar mass black holes and neutron stars, and can be used to trace the time variability of X-ray reverberation from the inner accretion disc. The previously-missing iron K reverberation time lags in the AGN IRAS 13224-3809 and MCG-6-30-15 are detected and found to be transitory in nature. Reverberation can be hidden during periods in which variability in the iron K band becomes dominated by ultrafast outflows (UFO). Following the time evolution of the reverberation lag between the corona and inner accretion disc, we may observe the short-timescale increase in scale height of the corona as it is accelerated away from the accretion disc during bright X-ray flares in the AGN I Zw 1. Measuring the variation of the reverberation lag that corresponds to the continuous, stochastic variations of the X-ray luminosity sheds new light on the disc-corona connection around accreting black holes. Hysteresis is observed between the X-ray count rate and the scale height of the corona, and a time lag of 10~40ks is observed between the rise in luminosity and the increase in reverberation lag. This correlation and lag are consistent with viscous propagation through the inner accretion disc, leading first to an increase in the flux of seed photons that are Comptonised by the corona, before mass accretion rate fluctuations reach the inner disc and are able to modulate the structure of the corona.
2309.13107v2
2023-10-13
Polarized microwave emission from space particles in the upper atmosphere of the Earth
Tons of space particles enter the Earth atmosphere every year, being detected when they produce fireballs, meteor showers, or when they impact the Earth surface. Particle detection in the showers could also be attempted from space using satellites in low Earth orbit. Measuring the polarization would provide extra crucial information on the dominant alignment mechanisms and the properties of the meteor families. In this article, we evaluate the expected signal to aid in the design of space probes for this purpose. We have used the RADMC-3D code to simulate the polarized microwave emission of aligned dust particles with different compositions: silicates, carbonates and irons. We have assumed a constant spatial particle density distribution of 0.22 cm$^{-3}$, based on particle density measurements carried during meteor showers. Four different grain size distributions with power indices ranging from $-3.5$ to $-2.0$ and dust particles with radius ranging from 0.01 $\mathrm{\mu}$m to 1 cm have been considered for the simulations. Silicates and carbonates align their minor axis with the direction of the solar radiation field; during the flight time into the Earth atmosphere, iron grains get oriented with the Earth's magnetic field depending on their size. Alignment direction is reflected in the $Q$-Stokes parameter and in the polarization variation along the orbit. Polarization depends on the composition and on the size distribution of the particles. The simulations show that some specific particle populations might be detectable even with a small probe equipped with high sensitivity, photon-counting microwave detectors operating in low Earth orbit.
2310.08941v1
2023-10-17
Towards atomistic understanding of Iron phosphate glass: a first-principles based DFT modeling and study of its physical properties
Iron phosphate glasses (IPG) have been proposed as futuristic glass material for nuclear waste immobilization, anode material for lithium batteries and also as bioactive glass. In the last decade, there have been attempts to propose atomistic models of IPG to explain their properties from atomistic viewpoint and to predict their behavior in radioactive environment. In this paper, we seek to produce small scale models of IPG that can be handled within the scheme of Density Functional Theory (DFT) to study the electronic structure of this material. The starting models generated using Monte Carlo (MC) method [S. Singh and S. Chandra, Comp. Mat. Sci., 202, 110943, (2022)] were subsequently annealed (at 1000 K) using ab-initio molecular dynamics (AIMD). This removes coordination defects present in the MC models. The equilibrated structure at this temperature was then force-relaxed using conjugate-gradient (CG) optimization. This hybrid approach (MC + AIMD + 0K DFT-CG optimization) produced good atomistic models of IPG which can reproduce experimentally observed electronic band-gap, vibrational density of states (VDOS), magnetic moment of Fe, the elastic constants as well as optical and dielectric properties. Computationally expensive melt-quench simulation can be avoided using present approach allowing the use of DFT for accurate calculations of properties of complex glass like IPG.
2310.11135v1
2023-10-25
Post-main sequence thermal evolution of planetesimals
White dwarfs that have accreted planetary materials provide a powerful tool to probe the interiors and formation of exoplanets. In particular, the high Fe/Si ratio of some white dwarf pollutants suggests that they are fragments of bodies that were heated enough to undergo large-scale melting and iron core formation. In the solar system, this phenomenon is associated with bodies that formed early and so had short-lived radionuclides to power their melting, and/or grew large. However, if the planetary bodies accreted by white dwarfs formed during the (pre)-main sequence lifetime of the host star, they will have potentially been exposed to a second era of heating during the star's giant branches. This work aims to quantify the effect of stellar irradiation during the giant branches on planetary bodies by coupling stellar evolution to thermal and orbital evolution of planetesimals. We find that large-scale melting, sufficient to form an iron core, can be induced by stellar irradiation, but only in close-in small bodies: planetesimals with radii $\lesssim$ 30 km originally within $\sim$ 2 AU orbiting a 1$-$3$\,M_{\odot}$ host star with solar metallicity. Most of the observed white dwarf pollutants are too massive to be explained by the accretion of these small planetesimals that are melted during the giant branches. Therefore, we conclude that those white dwarfs that have accreted large masses of materials with enhanced or reduced Fe/Si remain an indicator of planetesimal's differentiation shortly after formation, potentially linked to radiogenic heating.
2310.17057v1
2023-10-26
Honing cross-correlation tools for inference on ultra-high-energy cosmic-ray composition
The chemical composition of the highest-energy cosmic rays, namely the atomic number $Z$ of rays with energies $E\gg1~\text{EeV}$, remains to date largely unknown. Some information on the composition can be inferred from the deflections that charged ultra-high-energy cosmic rays experience while they traverse intervening magnetic fields. Indeed, such deflections distort and suppress the original anisotropy in the cosmic rays arrival directions; thus, a measure of the anisotropy is also a measurement of the deflections, which in turn informs us on the chemical composition. In this work, we show that, by quantifying ultra-high-energy cosmic ray anisotropies through the angular, harmonic cross-correlation between cosmic rays and galaxies, we are able to exclude iron fractions $f_{\rm Fe}\leq{\cal O}(10\%)$ on a fiducial hydrogen map at $2\sigma$ level, and even smaller fractions in the reverse case of hydrogen on an iron map, going below $f_{\rm H}\lesssim10\%$ when we mask the Galactic Centre up to latitudes of $40\,\text{deg}$. This is an improvement of a factor of a few compared to our previous method, and is mostly ascribable to a new test statistics which is sensitive to each harmonic multipole individually. Our method can be applied to real data as an independent test of the recent claim that current cosmic-ray data can not be reproduced by any existing model of the Galactic magnetic field, as well as an additional handle to compare any realistic, competing, data-driven composition models.
2310.17699v2
2023-10-31
Chemical evolution models: the role of type Ia supernovae in the $α$-elements over Iron relative abundances and their variations in time and space
The role of type Ia supernovae, mainly the Delay Time Distributions (DTDs) determined by the binary systems, and the yields of elements created by different explosion mechanisms, are studied by using the {\sc MulChem} chemical evolution model, applied to our Galaxy. We explored 15 DTDs, and 12 tables of elemental yields produced by different SN Ia explosion mechanisms, doing a total of 180 models. Chemical abundances for $\alpha$-elements (O, Mg, Si, S, Ca) and Fe derived from these models, are compared with recent observational data of $\alpha$-elements over Iron relative abundances, [X/Fe]. These data have been compiled and binned in 13 datasets. By using a $\chi^2$-technique, no model is able to fit simultaneously these datasets. A model computed with the 13 individual best models is good enough to reproduce them. Thus, a power law with a logarithmic slope $\sim -1.1$ and a delay in the range $\Delta \tau=40 --350$ Myr is a possible DTD, but a combination of several channels is more probable. Results of this average model for other disc regions show a high dispersion, as observed, which might be explained by the stellar migration. The dispersion might also come from a combination of DTDs or of explosion channels. The stellar migration joined to a combination of scenarios for SNIa is the probable cause of the observed dispersion.
2311.00076v1
2023-11-01
Annealing effects on the magnetic and magnetotransport properties of iron oxide nanoparticles self-assemblies
In magnetic tunnel junctions based on iron oxide nanoparticles the disorder and the oxidation state of the surface spin as well as the nanoparticles functionalization play a crucial role in the magnetotransport properties. In this work, we report a systematic study of the effects of vacuum annealing on the structural, magnetic and transport properties of self-assembled ~10 nm Fe3O4 nanoparticles. The high temperature treatment (from 573 to 873 K) decomposes the organic coating into amorphous carbon, reducing the electrical resistivity of the assemblies by 4 orders of magnitude. At the same time, the 3Fe2+/(Fe3++Fe2+) ratio is reduced from 1.11 to 0.13 when the annealing temperature of the sample increases from 573 to 873 K, indicating an important surface oxidation. Although the 2 nm physical gap remains unchanged with the thermal treatment, a monotonous decrease of tunnel barrier width was obtained from the electron transport measurements when the annealing temperature increases, indicating an increment in the number of defects and hot-spots in the gap between the nanoparticles. This is reflected in the reduction of the spin dependent tunneling, which reduces the interparticle magnetoresistance. This work shows new insights about influence of the nanoparticle interfacial composition, as well their the spatial arrangement, on the tunnel transport of self-assemblies, and evidence the importance of optimizing the nanostructure fabrication for increasing the tunneling current without degrading the spin polarized current.
2311.00700v1
2023-11-10
Enhancement of optical absorption in multiferroic (1-x)PZT-xPFN thin films: Experiments and first-principles analysis
Multiferroic compounds have gained research attention in the field of ferroelectric photovoltaics due to the presence of transition-metal d states from magnetic ions, which tend to reduce the bandgap value. In this work, 0.5Pb(Zr0.52Ti0.48)O3 - 0.5Pb(Fe0.5Nb0.5)O3 PZTFN0.5 thin films were synthesized using a sol-gel route to investigate the effect of iron doping on optical and multiferroic properties. For comparative analysis, the end-member compositions, Pb(Zr0.52Ti0.48)O3 (PZT) and Pb(Fe0.5Nb0.5)O3 (PFN), were also synthesized under identical conditions. Our results revealed that the presence of Fe ions, besides inducing multiferroic behavior, effectively enhances the optical absorption of the material in the visible light region. Optical transitions at 3.0 eV (2.4 eV) and 2.7 eV (2.2 eV) for the direct (indirect) bandgap were determined for PZTFN0.5 and PFN, respectively, indicating that the absorption edges of the iron-containing films result more promising than PZT (Eg 3.6eV) for photovoltaic applications. Both PZTFN0.5 and PFN thin films exhibit multiferroic behavior at room temperature, with different electric and magnetic properties. While PZTFN0.5 presents saturated hysteresis loops with remanent polarization values around 10 uC/cm2 and magnetization of 1.6 emu/cm2, PFN displays significantly larger remanence (31 emu/cm2) but poorer ferroelectric properties due to the presence of leakage. Microscopic insights into the structural and electronic properties of the PZTFN0.5 solid solution were provided from first-principles calculations.
2311.05855v1
2023-11-14
Superconductivity with $T_c$ up to 30.7 K in air-annealed CaFeAsF
Exploring new unconventional superconductors is of great value for both fundamental research and practical applications. It is a long-term challenge to develop and study more hole-doped superconductors in 1111 system of iron-based superconductors. However, fifteen years after the discovery of iron-based superconductors, it has become increasingly difficult to discover new members in this system by conventional means. Here we report the discovery of superconductivity with the critical transition temperature up to 30.7 K in the parent compound CaFeAsF by an annealing treatment in air atmosphere. The superconducting behaviors are verified in both the single-crystalline and polycrystalline samples by the resistance and magnetization measurements. The analysis by combining the depth-resolved time-of-flight secondary ion mass spectrometry (TOF-SIMS) and X-ray photoelectron spectroscopy (XPS) measurements show that the introduction of oxygen elements and the consequent changing in Fe valence by the annealing treatment may lead to the hole-type doping, which is the origin for the occurrence of superconductivity. Our results provide a new route to induce hole-doped superconductivity in Fe-based superconductors.
2311.07943v1
2023-12-14
X-ray Reflection from the Plunging Region of Black Hole Accretion Disks
Accretion around black holes is very often characterized by distinctive X-ray reflection features (mostly, iron inner-shell transitions), which arise due to the primary radiation being reprocessed by a dense and relatively colder medium, such as an accretion disk. Most reflection modeling assume that emission stops at the inner-most stable circular orbit (ISCO), and that for smaller radii - in the plunging region - the density drops and the accretion flow is far too ionized for efficient line production. We investigate the spectral features of the reflection in the plunging regions of optically-thick and geometrically-thin accretion disks around black holes. We show that for cases in which the density profile is considered constant (as expected in highly magnetized flows), or in cases in which the disk density is high enough such that the ionization still allows line formation within the ISCO, there is a significant modification of the observed reflected spectrum. Consistent with previous studies, we found that the impact of the radiation reprocessed in the plunging region is stronger the lower the black hole spin, when the plunging region subtends a larger area. Likewise, as for the case of standard reflection modeling, the relativistic broadening of the iron line is more pronounced at low inclination, whereas the blueshift and relativistic beaming effect is dominant at high inclination. We also tested the effects of various prescriptions of the stress at the ISCO radius on the reflection spectrum, and found that several of these cases appear to show line profiles distinct enough to be distinguishable with reasonably good quality observational data.
2312.09210v1
2024-01-05
Joint analysis of the iron emission in the optical and near-infrared spectrum of I Zw 1
Constraining the physical conditions of the ionized media in the vicinity of an active supermassive black hole (SMBH) is crucial to understanding how these complex systems operate. Metal emission lines such as iron (Fe) are useful probes to trace the gaseous media's abundance, activity, and evolution in these accreting systems. Among these, the FeII emission has been the focus of many prior studies to investigate the energetics, kinematics, and composition of the broad-emission line region (BELR) from where these emission lines are produced. In this work, we present the first simultaneous FeII modeling in the optical and near-infrared (NIR) regions. We use CLOUDY photoionization code to simulate both spectral regions in the wavelength interval 4000-12000 Angstroms. We compare our model predictions with the observed line flux ratios for IZw1 - a prototypical strong FeII-emitting active galactic nuclei (AGN). This allows putting constraints on the BLR cloud density and metal content that is optimal for the production of the FeII emission, which can be extended to IZw1-like sources, by examining a broad parameter space. We demonstrate the salient and distinct features of the FeII pseudo-continuum in the optical and NIR, giving special attention to the effect of micro-turbulence on the intensity of the FeII emission.
2401.02936v1
2024-01-16
Bias-Compensated State of Charge and State of Health Joint Estimation for Lithium Iron Phosphate Batteries
Accurate estimation of the state of charge (SOC) and state of health (SOH) is crucial for the safe and reliable operation of batteries. Voltage measurement bias highly affects state estimation accuracy, especially in Lithium Iron Phosphate (LFP) batteries, which are susceptible due to their flat open-circuit voltage (OCV) curves. This work introduces a bias-compensated algorithm to reliably estimate the SOC and SOH of LFP batteries under the influence of voltage measurement bias. Specifically, SOC and SOH are estimated using the Dual Extended Kalman Filter (DEKF) in the high-slope SOC range, where voltage measurement bias effects are weak. Besides, the voltage measurement biases estimated in the low-slope SOC regions are compensated in the following joint estimation of SOC and SOH to enhance the state estimation accuracy further. Experimental results indicate that the proposed algorithm significantly outperforms the traditional method, which does not consider biases under different temperatures and aging conditions. Additionally, the bias-compensated algorithm can achieve low estimation errors of below 1.5% for SOC and 2% for SOH, even with a 30mV voltage measurement bias. Finally, even if the voltage measurement biases change in operation, the proposed algorithm can remain robust and keep the estimated errors of states around 2%.
2401.08136v2
2024-01-19
Reflecting on naked singularities: iron line fitting as a probe of the cosmic censorship conjecture
We demonstrate that the X-ray iron line fitting technique can be leveraged as a powerful probe of the cosmic censorship conjecture. We do this by extending existing emission line models to arbitrary spin parameters of the Kerr metric, no longer restricted to black hole metrics with $|a_\bullet |< 1$. We show that the emission lines from naked singularity metrics ($|a_\bullet| > 1$) show significant differences to their black hole counterparts, even for those metrics with identical locations of the innermost stable circular orbit, i.e., emission line fitting does not suffer from the degeneracy which affects continuum fitting approaches. These differences are entirely attributable to the disappearance of the event horizon for $|a_\bullet| > 1$. We highlight some novel emission line features of naked singularity metrics, such as ``inverted'' emission lines (with sharp red wings and extended blue wings) and ``triple lines''. The lack of detection of any of these novel features provides support of the cosmic censorship conjecture. We publicly release {\tt XSPEC} packages {\tt skline} and {\tt skconv} which can now be used to probe the cosmic censorship conjecture in Galactic X-ray binaries and Active Galactic Nuclei. The inclusion of super-extremal spacetimes can be alternatively posed as a way of stress-testing conventional models of accretion.
2401.10565v1
2024-01-25
Nucleosynthesis in magnetorotational supernovae: impact of the magnetic field configuration
The production of heavy elements is one of the main by-products of the explosive end of massive stars. A long sought goal is finding differentiated patterns in the nucleosynthesis yields, which could permit identifying a number of properties of the explosive core. Among them, the traces of the magnetic field topology are particularly important for \emph{extreme} supernova explosions, most likely hosted by magnetorotational effects. We investigate the nucleosynthesis of five state-of-the-art magnetohydrodynamic models with fast rotation that have been previously calculated in full 3D and that involve an accurate neutrino transport (M1). One of the models does not contain any magnetic field and synthesizes elements around the iron group, in agreement with other CC-SNe models in literature. All other models host a strong magnetic field of the same intensity, but with different topology. For the first time, we investigate the nucleosynthesis of MR-SNe models with a quadrupolar magnetic field and a 90 degree tilted dipole. We obtain a large variety of ejecta compositions reaching from iron nuclei to nuclei up to the third r-process peak. We assess the robustness of our results by considering the impact of different nuclear physics uncertainties such as different nuclear masses, $\beta^{-}$-decays and $\beta^{-}$-delayed neutron emission probabilities, neutrino reactions, fission, and a feedback of nuclear energy on the temperature. We find that the qualitative results do not change with different nuclear physics input. The properties of the explosion dynamics and the magnetic field configuration are the dominant factors determining the ejecta composition.
2401.14402v1
2024-02-15
A variable ionized disk wind in MAXI J1803-298 revealed by NICER
We present the results from the NICER observation data of MAXI J1803-298 across the entire 2021 outburst. In the intermediate and soft state, we detect significant absorption lines at $\sim 7.0$ keV and $\sim 6.7$ keV, arising from the X-ray disk wind outflowing with a velocity of hundreds of km per second along our line of sight. The fitting results from photoionized model suggest that the wind is driven by thermal pressure and the mass-loss rate is low. We find a clear transition for iron from predominantly H-like to predominantly He-like during the intermediate-to-soft state transition. Our results indicate this transition for iron is caused by the evolution of the illuminating spectrum and the slow change of the geometric properties of the disk wind together. The coexistence of disk wind and QPOs features in intermediate state is also reported. Our study makes MAXI J1803-298 the first source in which a transition from optical wind to X-ray wind is detected, offering new insights into the evolution of disk winds across an entire outburst and long-term coupling of accretion disks and mass outflows around accreting black holes.
2402.10315v1
2024-03-04
Interplay between alloying and tramp element effects on temper embrittlement in bcc iron: DFT and thermodynamic insights
The details of the temper embrittlement mechanism in steels caused by impurities are unknown. Especially from an atomistic point of view, there are still open questions regarding their interactions with alloying elements such as Ni, Cr, and Mo. Therefore, we used density functional theory to investigate the segregation and co-segregation behavior and the resulting influence on the cohesion of three representative tilt grain boundaries in iron. The results are implemented in a multi-site and multi-component kinetic and thermodynamic model for grain boundary segregation, to gain insights into the temporal and final grain boundary coverage. Our results show that the segregation tendency of As, Sb, and Sn is stronger than that of the alloying elements and significantly mitigates the grain boundary cohesion. Depending on the GB type, interactions between Sb and Sn vary from negligible to strongly attractive, which increases the likelihood of co-segregation. The cohesion-weakening effect is further amplified when elements such as Sb, Sn, and As co-segregate, compared to their individual segregation. In contrast, the co-segregation of Ni and Cr does not significantly increase the enrichment of impurities at grain boundaries, and their impact on cohesion is found to be negligible. The ability of Mo to mitigate reversible temper embrittlement is primarily attributed to its cohesion-enhancing effect and its capability to repel tramp elements from GBs, rather than scavenging them within the bulk, as suggested by previous literature.
2403.02186v1
2024-03-10
Conventional Superconductivity in the Doped Kagome Superconductor Cs(V0.86Ta0.14)3Sb5 from Vortex Lattice Studies
A hallmark of unconventional superconductors is their complex electronic phase diagrams where "intertwined orders" of charge-spin-lattice degrees of freedom compete and coexist as in copper oxides and iron pnictides. While the electronic phase diagram of kagome lattice superconductor such as CsV3Sb5 also exhibits complex behavior involving coexisting and competing charge density wave order and superconductivity, much is unclear about the microscopic origin of superconductivity. Here, we study the vortex lattice (VL) in superconducting state of Cs(V0.86Ta0.14)3Sb5, where the Ta-doping suppresses charge order and enhances superconductivity. Using small-angle neutron scattering, a strictly bulk probe, we show that the VL exhibits a strikingly conventional behavior. This includes a triangular VL with a period consistent with 2e-pairing, a field dependent scattering intensity that follows a London model, and a temperature dependence consistent with a uniform superconducting gap expected for s-wave pairing. These results suggest that optimal bulk superconductivity in Cs(V1-xTax)3Sb5 arises from a conventional Bardeen-Cooper-Schrieffer electron-lattice coupling, different from spin fluctuation mediated unconventional copper and iron based superconductors.
2403.06046v1
2024-03-14
An FFT based approach to account for elastic interactions in OkMC: Application to dislocation loops in iron
Object kinetic Montecarlo (OkMC) is a fundamental tool for modeling defect evolution in volumes and times far beyond atomistic models. The elastic interaction between defects is classically considered using a dipolar approximation but this approach is limited to simple cases and can be inaccurate for large and close interacting defects. In this work a novel framework is proposed to include "exact" elastic interactions between defects in OkMC valid for any type of defect and anisotropic media. In this method, the elastic interaction energy of a defect is computed by volume integration of its elastic strain multiplied by the stress created by all the other defects, being both fields obtained numerically using a FFT solver. The resulting interaction energies reproduce analytical elastic solutions and show the limited accuracy of dipole approaches for close and large defects. The OkMC framework proposed is used to simulate the evolution in space and time of self-interstitial atoms and dislocation loops in iron. It is found that including the anisotropy has a quantitative effect in the evolution of all the type of defects studied. Regarding dislocation loops, it is observed that using the "exact" interaction energy result in higher interactions than using the dipole approximation for close loops.
2403.09158v1
2024-03-18
Primary Defect Production in Doped Iron Grain Boundaries during Low Energy Collision Cascades
This study explores the intricate interactions between grain boundaries (GBs) and irradiation-induced defects in nanocrystalline iron, highlighting the role of dopants like copper. Utilizing molecular dynamics simulations, the research delineates how GB properties, such as GB energy and defect formation energies, influence the formation and evolution of defects in low energy collision cascades. It reveals that GBs not only augment defect production but also show a marked preference for interstitials over vacancies, a behavior significantly modulated by the cascade's proximity to the GB. The presence of dopants is shown to alter GB properties, affecting both the rate and type of defect production, thereby underscoring the complex interplay between GB characteristics, dopant elements, and defect dynamics. Moreover, the investigation uncovers that the structural characteristics of GBs play a crucial role in cascade evolution and defect generation, with certain GB configurations undergoing reconfiguration in response to cascades. For instance, the reconfiguration of one pure Fe twist GB suggests that GB geometry can significantly influence defect generation mechanisms. These findings point to the potential of GB engineering in developing materials with enhanced radiation tolerance, advocating for a nuanced approach to material design. By tailoring GB properties and selectively introducing dopant elements, materials can be optimized to exhibit superior resistance to radiation-induced damage, offering insights for applications in nuclear reactors and other radiation-prone environments.
2403.12257v1
2022-04-02
Direct Measurement of the Nickel Spectrum in Cosmic Rays in the Energy Range from 8.8 GeV/n to 240 GeV/n with CALET on the International Space Station
The relative abundance of cosmic ray nickel nuclei with respect to iron is by far larger than for all other trans-iron elements, therefore it provides a favorable opportunity for a low background measurement of its spectrum. Since nickel, as well as iron, is one of the most stable nuclei, the nickel energy spectrum and its relative abundance with respect to iron provide important information to estimate the abundances at the cosmic ray source and to model the Galactic propagation of heavy nuclei. However, only a few direct measurements of cosmic-ray nickel at energy larger than $ \sim$ 3 GeV/n are available at present in the literature and they are affected by strong limitations in both energy reach and statistics. In this paper we present a measurement of the differential energy spectrum of nickel in the energy range from 8.8 to 240 GeV/n, carried out with unprecedented precision by the Calorimetric Electron Telescope (CALET) in operation on the International Space Station since 2015. The CALET instrument can identify individual nuclear species via a measurement of their electric charge with a dynamic range extending far beyond iron (up to atomic number $ Z $ = 40). The particle's energy is measured by a homogeneous calorimeter (1.2 proton interaction lengths, 27 radiation lengths) preceded by a thin imaging section (3 radiation lengths) providing tracking and energy sampling. This paper follows our previous measurement of the iron spectrum [O. Adriani et al., Phys. Rev. Lett. 126, 241101 (2021).], and it extends our investigation on the energy dependence of the spectral index of heavy elements. It reports the analysis of nickel data collected from November 2015 to May 2021 and a detailed assessment of the systematic uncertainties. In the region from 20 to 240 GeV$ /n $ our present data are compatible within the errors with a single power law with spectral index $ -2.51 \pm 0.07 $.
2204.00845v1
2020-12-03
On the Use of Field RR Lyrae as Galactic Probes. II. A new $Δ$S calibration to estimate their metallicity
We performed the largest and most homogeneous spectroscopic survey of field RR Lyraes (RRLs). We secured $\approx$6,300 high resolution (HR, R$\sim$35,000) spectra for 143 RRLs (111 fundamental, RRab; 32 first overtone, RRc). The atmospheric parameters were estimated by using the traditional approach and the iron abundances were measured by using an LTE line analysis. The resulting iron distribution shows a well defined metal-rich tail approaching solar iron abundance. This suggests that field RRLs experienced a complex chemical enrichment in the early halo formation. We used these data to develop a new calibration of the $\Delta$S method. This diagnostic, based on the equivalent widths of CaII K and three Balmer (H$_{\delta,\gamma,\beta}$) lines, traces the metallicity of RRLs. For the first time the new empirical calibration: i) includes spectra collected over the entire pulsation cycle; ii) includes RRc variables; iii) relies on spectroscopic calibrators covering more than three dex in iron abundance; iv) provides independent calibrations based on one/two/three Balmer lines. The new calibrations were applied to both SEGUE-SDSS and degraded HR spectra totalling 6,451 low resolution (LR, R$\sim$2,000) spectra for 5,001 RRLs (3,439 RRab, 1,562 RRc). This resulted in an iron distribution with a median of -1.55$\pm$0.01 and $\sigma$=0.51 dex, in good agreement with literature values. We also found that RRc are 0.10 dex more metal-poor than RRab variables, and have a distribution with a smoother metal-poor tail. This finding supports theoretical prescriptions suggesting a steady decrease in the RRc number when moving from metal-poor to metal-rich stellar environments.
2012.02284v1