Thermal Effects and Halide Mixing of Hybrid Perovskites: MD and XPS Studies.

Thermal effects in organo-metal halide perovskites are studied by ab initio molecular dynamics (MD) simulations performed at effective temperatures of 293 and 383 K and by X-ray photoelectron spectroscopy (XPS). We find that the cause of thermal instability in this class of perovskites is the rotation of the methylammonium (MA) groups that destroy the rigid lattice of pure compounds (MAPbI and MAPbBr). When the Pb-I lattice is initially distorted by partial replacement of the I with Cl or Br, this not only prevents formation of PbI seeds but also improves lattice flexibility and stability against the temperature-induced motion and rotation of MA groups.

Scaling theory of magnetism in frustrated Kondo lattices.

A scaling theory of the Kondo lattices with frustrated exchange interactions is developed, criterium of antiferromagnetic ordering and quantum-disordered state being investigated. The calculations taking into account magnon and incoherent spin dynamics are performed. Depending on the bare model parameters, one or two quantum phase transitions into non-magnetic spin-liquid and Kondo Fermi-liquid ground states can occur with increasing the bare coupling constant.

DC Self-Field Critical Current in Superconductor Dirac-Cone Material/Superconductor Junctions.

Recently, several research groups have reported on anomalous enhancement of the self-field critical currents, (sf,), at low temperatures in superconductor/Dirac-cone material/superconductor (S/DCM/S) junctions. Some papers attributed the enhancement to the low-energy Andreev bound states arising from winding of the electronic wave function around DCM. In this paper, (sf,) in S/DCM/S junctions have been analyzed by two approaches: modified Ambegaokar-Baratoff and ballistic Titov-Beenakker models.

p-wave superconductivity in iron-based superconductors.

The possibility of p-wave pairing in superconductors has been proposed more than five decades ago, but has not yet been convincingly demonstrated. One difficulty is that some p-wave states are thermodynamically indistinguishable from s-wave, while others are very similar to d-wave states. Here we studied the self-field critical current of NdFeAs(O,F) thin films in order to extract absolute values of the London penetration depth, the superconducting energy gap, and the relative jump in specific heat at the superconducting transition temperature, and find that all the deduced physical parameters strongly indicate that NdFeAs(O,F) is a bulk p-wave superconductor.

Magnetic Nanoclusters Coated with Albumin, Casein, and Gelatin: Size Tuning, Relaxivity, Stability, Protein Corona, and Application in Nuclear Magnetic Resonance Immunoassay.

The surface functionalization of magnetic nanoparticles improves their physicochemical properties and applicability in biomedicine. Natural polymers, including proteins, are prospective coatings capable of increasing the stability, biocompatibility, and transverse relaxivity (r2) of magnetic nanoparticles. In this work, we functionalized the nanoclusters of carbon-coated iron nanoparticles with four proteins: bovine serum albumin, casein, and gelatins A and B, and we conducted a comprehensive comparative study of their properties essential to applications in biosensing.

Ferrogels Ultrasonography for Biomedical Applications.

Ferrogels (FG) are magnetic composites that are widely used in the area of biomedical engineering and biosensing. In this work, ferrogels with different concentrations of magnetic nanoparticles (MNPs) were synthesized by the radical polymerization of acrylamide in stabilized aqueous ferrofluid. FG samples were prepared in various shapes that are suitable for different characterization techniques.

High-Energy and High-Power-Density Potassium Ion Batteries Using Dihydrophenazine-Based Polymer as Active Cathode Material.

Polymeric aromatic amines were shown to be very promising cathodes for lithium-ion batteries. Surprisingly, these materials are scarcely used for designing post-lithium batteries. In this Letter, we investigate the application of the high-voltage poly(-phenyl-5,10-dihydrophenazine) (p-DPPZ) cathodes for K-ion batteries.

Quantum Diffusion of Deuterium in Sodium.

The online nuclear reaction analysis technique has been applied to study the temperature dependence of deuterium diffusion coefficients for deuterium in sodium at temperatures ranging between 110 and 240 K, and at cryogenic temperatures, below 160 K, tunneling of deuterium atoms in the metal lattice has been observed. Above 160 K, diffusion occurs by the classical mechanism of overbarrier atomic jumps. Results of quantum diffusion of deuterium in a metal have been obtained for the first time; they used to be known only for the lightest hydrogen isotope, protium, in niobium and tantalum.

Magnetic hyperthermia in a system of immobilized magnetically interacting particles.

This paper deals with the theoretical study of magnetic hyperthermia, induced by a system of immobilized single-domain ferro- (ferri-) magnetic particles under the action of an oscillating magnetic field. It is supposed that the particles are randomly distributed in a host medium. The effect of magnetic interparticle interaction on the intensity of the heat production is the focus of our attention.

Preparation, Crystal Chemistry, and Hidden Magnetic Order in the Family of Trigonal Layered Tellurates AMn(4+)TeO (A = Li, Na, Ag, or Tl).

We report the first four magnetic representatives of the trigonal layered AM(4+)TeO (here, M = Mn) family. NaMnTeO was synthesized from NaMnO, NaNO, and TeO at 650-720 °C, but analogues for which A = Li and K could not be obtained by direct synthesis. However, those for which A = Li, Ag, and Tl (but not K) were prepared by exchange reactions between NaMnTeO and the corresponding molten nitrates.

Effect of interparticle interaction on magnetic hyperthermia: homogeneous spatial distribution of the particles.

The paper deals with the theoretical study of the effect of magnetic interparticle interaction on magnetic hyperthermia, produced by the particles under the action of a linearly polarized oscillating field. The particles are homogeneously distributed and immobilized in a rigid medium. The supposed size of the magnetite particles is about 20-30 nm.

Effect of internal chain-like structures on magnetic hyperthermia in non-liquid media.

This paper deals with a theoretical study of the effect of chain-like aggregates on magnetic hyperthermia in systems of single-domain ferromagnetic particles immobilized in a non-magnetic medium. We assume that the particles form linear chain-like aggregates and the characteristic time of the Néel remagnetization is much longer than the time of medium heating (time of process observation). This is applicable to magnetite particles when the particle diameter exceeds 20-25 nm.

Resonant inelastic x-ray incarnation of Young's double-slit experiment.

Young's archetypal double-slit experiment forms the basis for modern diffraction techniques: The elastic scattering of waves yields an interference pattern that captures the real-space structure. Here, we report on an inelastic incarnation of Young's experiment and demonstrate that resonant inelastic x-ray scattering (RIXS) measures interference patterns, which reveal the symmetry and character of electronic excited states in the same way as elastic scattering does for the ground state. A prototypical example is provided by the quasi-molecular electronic structure of insulating BaCeIrO with structural Ir dimers and strong spin-orbit coupling.

Conjugation of carbon coated-iron nanoparticles with biomolecules for NMR-based assay.

In this work, we developed and optimized conjugates of carbon-coated iron nanoparticles (Fe@C) with streptavidin and monoclonal antibodies. The conjugation procedure included two stages. First, amino groups were grafted onto the carbon shell to facilitate noncovalent sorption of bovine serum albumin (BSA).

γ-Ray-Induced Degradation in the Triple-Cation Perovskite Solar Cells.

We report on the impact of γ radiation (0-500 Gy) on triple-cation CsMAFAPb(BrI) perovskite solar cells. A set of experiments was designed to reveal the individual contributions of the hole-collecting bottom electrode, perovskite absorber, and electron transport layer (ETL) to the overall solar cell degradation under radiation exposure. We show that the glass/ITO/PEDOT:PSS hole-collecting electrode withstands a 500 Gy dose without any losses in the solar cell performance.

The onset of dissipation in high-temperature superconductors: magnetic hysteresis and field dependence.

Recently, we showed that the self-field transport critical current, I(sf), of a superconducting wire can be defined in a more fundamental way than the conventional (and arbitrary) electric field criterion, E = 1 μV/cm. We defined I(sf) as the threshold current, I, at which the perpendicular component of the local magnetic flux density, B, measured at any point on the surface of a high-temperature superconducting tape abruptly crosses over from a non-linear to a linear dependence with increasing transport current. This effect results from the current distribution across the tape width progressively transitioning from non-uniform to uniform.

Titanium Dichalcogenides as Nanoreactors for Magnetic High-Anisotropy Phases.

Composite single crystals consisting of nanoscaled FeSe inclusions encapsulated into the interlayer space of TiSe matrix were obtained by the decay of homogeneous FeTiSe intercalation compound. These composites have a high magnetic anisotropy due to the coherent bond between inclusions and the host lattice of TiSe. The influence of selenium pressure over the composite surface on the composition of the inclusions is studied, and the possibility of controlling their content is demonstrated.

Shear Elasticity of Magnetic Gels with Internal Structures.

We present the results of the theoretical modeling of the elastic shear properties of a magnetic gel, consisting of soft matrix and embedded, fine magnetizable particles, which are united in linear chain-like structures. We suppose that the composite is placed in a magnetic field, perpendicular to the direction of the sample shear. Our results show that the field can significantly enhance the mechanical rigidity of the soft composite.

Nuclear resonance reflectivity from a [Fe/Cr] multilayer with the Synchrotron Mössbauer Source.

Mössbauer reflectivity spectra and nuclear resonance reflectivity (NRR) curves have been measured using the Synchrotron Mössbauer Source (SMS) for a [Fe/Cr] periodic multilayer, characterized by the antiferromagnetic interlayer coupling between adjacent Fe layers. Specific features of the Mössbauer reflectivity spectra measured with π-polarized radiation of the SMS near the critical angle and at the `magnetic' maximum on the NRR curve are analyzed. The variation of the ratio of lines in the Mössbauer reflectivity spectra and the change of the intensity of the `magnetic' maximum under an applied external field has been used to reveal the transformation of the magnetic alignment in the investigated multilayer.

Recombinant Human Bone Morphogenetic Protein-2 (rhBMP-2) with Additional Protein Domain Synthesized in E. coli: In Vivo Osteoinductivity in Experimental Models on Small and Large Laboratory Animals.

Recombinant human bone morphogenetic protein-2 with an additional s-tag domain (s-tag-BMP-2) synthesized in E. coli is characterized by higher solubility and activity than the protein without additional s-tag domain, which increases the yield during purification and simplifies protein introduction into the osteoplastic materials. The high osteoinductivity of the demineralized bone matrix with s-tag-BMP-2 was shown on the model of regeneration of cranial defects of a critical size in mice and on the model of implantation of porous titanium matrix into defects of femoral and tibial bones in rabbits.

Shear elasticity of isotropic magnetic gels.

The paper deals with a theoretical study of the effective shear modulus of a magnetic gel, consisting of magnetizable particles randomly and isotropically distributed in an elastic matrix. The effect of an external magnetic field on the composite modulus is the focus of our consideration. We take into account that magnetic interaction between the particles can induce their spatial rearrangement and lead to internal anisotropy of the system.

ITO Modification for Efficient Inverted Organic Solar Cells.

We demonstrate a facile approach to designing transparent electron-collecting electrodes by depositing thin layers of medium and low work function metals on top of transparent conductive metal oxides (TCOs) such as ITO and FTO. The modified electrodes were fairly stable for months under ambient conditions and maintained their electrical characteristics. XPS spectroscopy data strongly suggested integration of the deposited metal in the TCO structure resulting in additional doping of the conducting oxide at the interface.

Local magnetic moments in iron and nickel at ambient and Earth's core conditions.

Some Bravais lattices have a particular geometry that can slow down the motion of Bloch electrons by pre-localization due to the band-structure properties. Another known source of electronic localization in solids is the Coulomb repulsion in partially filled d or f orbitals, which leads to the formation of local magnetic moments. The combination of these two effects is usually considered of little relevance to strongly correlated materials.

Bulk vs. Surface Structure of 3d Metal Impurities in Topological Insulator BiTe.

Topological insulators have become one of the most prominent research topics in materials science in recent years. Specifically, BiTe is one of the most promising for technological applications due to its conductive surface states and insulating bulk properties. Herein, we contrast the bulk and surface structural environments of dopant ions Cr, Mn, Fe, Co, Ni, and Cu in BiTe thin films in order to further elucidate this compound.

Probing the Intrinsic Thermal and Photochemical Stability of Hybrid and Inorganic Lead Halide Perovskites.

We report a careful and systematic study of thermal and photochemical degradation of a series of complex haloplumbates APbX (X = I, Br) with hybrid organic (A = CHNH) and inorganic (A = Cs) cations under anoxic conditions (i.e., without exposure to oxygen and moisture by testing in an inert glovebox environment).