Kazan Scientific Center

Abstract The term ‘straintronics’ refers to a new research area in condensed matter physics, in which strain engineering methods and strain-induced physical effects in solids are used to develop next-generation devices for information, sensor, and energy-saving technologies. This paper reviews the basic ideas of straintronics, examines the underlying effects, highlights its advantages over conventional electronics, and identifies the problems it faces and fundamental constraints it is subject to. Special attention is given to the straintronics of magnetic and magnetoelectric materials as the most promising area for radically reducing computational energy consumption. Specific examples are presented of how the principles of straintronics are applied practically in information and energy-saving technologies, as well as in sensor and microwave engineering.

We have studied the dependence of the superconducting (SC) transition temperature on the mutual orientation of magnetizations of Fe1 and Fe2 layers in the spin valve system CoO(x)/Fe1/Cu/Fe2/Pb. We find that this dependence is nonmonotonic when passing from the parallel to the antiparallel case and reveals a distinct minimum near the orthogonal configuration. The analysis of the data in the framework of the SC triplet spin valve theory gives direct evidence for the long-range triplet superconductivity arising due to noncollinearity of the two magnetizations.

Abstract Multi‐color fluorescent nanodiamonds (FNDs) containing a variety of color centers are promising fluorescent markers for biomedical applications. Compared to colloidal quantum dots and organic dyes, FNDs have the advantage of lower toxicity, exceptional chemical stability, and better photostability. They can be surface functionalized by techniques similar to those used for other nanoparticles. They exhibit a variety of emission wavelengths from visible to near infrared, with narrow or broad bandwidths depending on their color centers. In addition, some color centers can detect changes in magnetic fields, electric fields, and temperature. In this article review, we will discuss the current trends in FND’s development, including comparison to the early development of quantum dots. We will also highlight some of the latest advances in fabrication, as well as demonstrations of their use in bioimaging and biosensing.

Multiple sclerosis (MS) is an autoimmune neurodegenerative disease characterized by chronic brain inflammation. Leukocyte infiltration of brain tissue causes inflammation, demyelination, and the subsequent formation of sclerotic plaques, which are a hallmark of MS. Activation of proinflammatory cytokines is essential for regulation of lymphocyte migration across the blood-brain barrier. We demonstrate increased levels of many cytokines, including IL-2RA, CCL5, CCL11, MIF, CXCL1, CXCL10, IFNγ, SCF, and TRAIL, were upregulated in cerebrospinal fluid (CSF), whereas IL-17, CCL2, CCL3, CCL4, and IL-12(p40) were activated in MS serum. Interaction analysis of cytokines in CSF demonstrated a connection between IFNγ and CCL5 as well as MIF. Many cells can contribute to production of these cytokines including CD8 and Th1 lymphocytes and astrocytes. Therefore, we suggest that IFNγ released by Th1 lymphocytes can activate astrocytes, which then produce chemoattractants, including CCL5 and MIF. These chemokines promote an inflammatory milieu and interact with multiple chemokines including CCL27 and CXCL1. Of special note, upregulation of CCL27 was found in CSF of MS cases. This observation is the first to demonstrate CCL27 as a potential contributor of brain pathology in MS. Our data suggest that CCL27 may be involved in activation and migration of autoreactive encephalitogenic immune effectors in the brain. Further, our data support the role of Th1 lymphocytes in the pathogenesis of brain inflammation in MS, with several cytokines playing a central role.

The spin–orbit charge-transfer-induced intersystem crossing (SOCT-ISC) in Bodipy-phenoxazine (BDP-PXZ) compact electron-donor/-acceptor dyads was studied. PXZ is the electron donor, and BDP is the electron acceptor. The molecular geometry is varied by applying different steric hindrance on the rotation about the linker between the two subunits. Charge-transfer (CT) absorption bands were observed for the dyads with more coplanar geometry (electronic coupling matrix elements is up to 2580 cm–1). Ultrafast charge separation (0.4 ps) and slow charge recombination (3.8 ns, i.e., SOCT-ISC process) were observed. Efficient ISC (ΦT = 54%) and long triplet-state lifetime (τT = 539 μs) were observed for the dyads. Notably, the triplet-state lifetime is 2-fold of that accessed with heavy-atom effect, indicating the advantage of using a heavy-atom-free photosensitizer. The low-lying CT state in the dyads in polar solvents was confirmed with intermolecular triplet photosensitizing method. Time-resolved electron paramagnetic resonance spectroscopy show that the electron spin polarization of the triplet state formed by the SOCT-ISC is the same as that of spin–orbit-ISC (SO-ISC). 3CT and localized excited triplet states (3LE) were simultaneously observed for one of the dyads, which is rare. Normally, the CT state was observed as spin-correlated radical pair. The dyads were used as triplet photosensitizers for triplet–triplet annihilation upconversion, the quantum yield is up to 12.3%. A large anti-Stokes shift (5905 cm–1) was achieved by excitation into the CT absorption band, not the conventional LE absorption band.

The use of metal and metal oxide nanoparticles is frequently regarded as a potential solution to the issue of bacterial antibiotic resistance. Among the proposed range of nanoparticles with antibacterial properties, copper oxide nanoparticles are of particular interest. Although the antibacterial properties of copper have been known for a considerable period of time, studies on the effects of copper oxide nanomaterials with respect to biological systems have attracted considerable attention in recent years. This review presents a summary of the antibacterial properties of copper oxide nanoparticles, the mechanisms by which the antibacterial effect is realized, and the key reported methods of modifying these nanoparticles to improve their antibacterial activity. A comparative analysis of the effectiveness of these nanoparticles is presented depending on the type of microorganism, the shape of the nanoparticles, and the Gram classification of bacteria based on data from published sources. In addition, the review addresses the biological activities of copper oxide nanoparticles, including their antifungal and cytotoxic properties, as well as their "antioxidant" activity. According to the conducted analysis of the literature data, it can be concluded that copper oxide nanoparticles have a significant bacteriostatic potential with respect to a wide range of microorganisms and, in some cases, contribute to the inhibition of fungal growth. At the same time, the sensitivity of Gram-positive bacteria to the effect of copper oxide nanoparticles was often higher than that of Gram-negative bacteria.

Thirty endophytic bacteria were isolated from various plant species growing near Saint-Petersburg, Russia. Based on a screening for various traits, including plant-beneficial properties and DNA fragment patterns, potential siblings were removed. The remaining isolates were taxonomically identified using 16S rDNA sequences and potential human and plant pathogens were removed. The remaining strains were tested for their ability to promote radish root growth and to protect tomato plants against tomato foot and root rot. One strain, Bacillus subtilis HC8, isolated from the giant hogweed Heracleum sosnowskyi Manden, significantly promoted plant growth and protected tomato against tomato foot and root rot. Metabolites possibly responsible for these plant-beneficial properties were identified as the hormone gibberellin and (lipo)peptide antibiotics respectively. The antibiotic properties of strain HC8 are similar to those of the commercially available plant-beneficial strain Bacillus amyloliquefaciens FZB42. However, thin layer chromatography profiles of the two strains differ. It is speculated that endophytes such as B. subtilis HC8 contribute to the fast growth of giant hogweed.

Spin-orbit charge transfer-induced intersystem crossing (SOCT-ISC) is of particular interest for preparation of heavy atom-free triplet photosensitizers. Up to now, examples for SOCT-ISC dyads are limited and electron donor/acceptor SOCT-ISC dyads showing strong visible-light harvesting are rare. Herein, we studied the photophysics of a series of Bodipy-anthracene (BDP-An) compact dyads, especially the triplet state electron spin dynamics with the time-resolved electron paramagnetic resonance (TREPR) spectroscopy. The electronic coupling matrix elements (VDA*) between the 1CT (charge transfer) state and 1LE (locally excited) state are in the range 773–1545 cm–1. For one dyad, we observed three triplet states simultaneously with TREPR, that is triplet states confined on the anthracene (3An) and the Bodipy (3BDP) moieties as well as a 3CT state. Based on the electron spin polarization of these three triplet states and the optical experiments, the SOCT-ISC mechanism is confirmed and the radical pair-ISC mechanism as the main ISC channel was excluded. Triplet–triplet annihilation-induced delayed fluorescence was observed for the dyads, which is rare for Bodipy fluorophores.

The aim of this work is to convince practitioners of (31)P NMR methods to regard simple GIAO quantum chemical calculations as a safe tool in structural analysis of organophosphorus compounds. A comparative analysis of calculated GIAO versus experimental (31)P NMR chemical shifts (CSs) for a wide range of phosphorus containing model compounds was carried out. A variety of combinations (at the HF, DFT (B3LYP and PBE1PBE), and MP2 levels using 6-31G(d), 6-31+G(d), 6-31G(2d), 6-31G(d,p), 6-31+G(d,p), 6-311G(d), 6-311G(2d,2p), 6-311++G(d,p), 6-311++G(2d,2p), and 6-311++G(3df,3pd) basis sets) were tested. On the whole, it is shown that, in contrast to what is claimed in the literature, high level of theory is not needed to obtain rather accurate predictions of (31)P CSs by the GIAO method. The PBE1PBE/6-31G(d)//PBE1PBE/6-31G(d) level can be recommended for express estimation of (31)P CSs. The PBE1PBE/6-31G(2d)//PBE1PBE/6-31G(d) combination can be recommended for routine applications. The PBE1PBE/6-311G(2d,2p)//PBE1PBE/6-31+G(d) level can be proposed to obtain better results at a reasonable cost. Scaling by linear regression parameters significantly improves results. The results obtained using these combinations were demonstrated in (31)P CS calculations for a variety of medium (large) size organic compounds of practical interest. Care has to be taken for compounds that may be involved in exchange between different structural forms (self-associates, associates with solvent, tautomers, and conformers). For phosphorus located near the atoms of third period elements ((CH3)3PS and P(SCH3)3) the impact of relativistic effects may be notable.

Controlling the electronic coupling between electron donor and acceptor subunits in a dyad is pivotal for the development of novel organic materials, for instance, thermally activated delayed fluorescence (TADF) materials and triplet photosensitizers. Herein, we prepared two compact electron donor/acceptor dyads based on phenothiazine (PTZ) and naphthalimide (NI) with different conformation restrictions induced by the C–N (NI-N-PTZ) or C–C (NI-C-PTZ) linkers. The effect of electronic coupling (matrix elements, VDA) on the photophysical properties, especially the intersystem crossing (ISC) and the TADF, were investigated. NI-C-PTZ shows stronger ground-state electronic coupling (VDA = 2548 cm–1) compared to NI-N-PTZ (VDA = 870 cm–1). TADF was observed only for NI-N-PTZ due to its smaller electronic coupling. Time-resolved electron paramagnetic resonance (TREPR) spectroscopy indicated the presence two triplet excited states and three ISC mechanisms in NI-N-PTZ with different electron spin polarizations (ESP): radical pair ISC (RP-ISC) and spin–orbital charge transfer ISC (SOCT-ISC) for one triplet state, and spin–orbital coupling ISC (SO-ISC) for another. Moreover, for the second one, an inversion of the electron spin polarization (ESP) was observed at 0.5–1.1 μs delay time. NI-N-PTZ represents a rare example for compact electron donor/acceptor dyad showing TADF emission in the red spectral region.

The aim of the research was to study the effectiveness of substances with an immunostimulating effect in T-2 mycotoxicosis. Subacute T-2 mycotoxicosis was simulated in male, white Wistar rats by administering intragastrically, a toxic at a dose of 1/5 LD50 (0.64 mg/kg of body weight) for 15 days, at the same time the animals were immunized with the vaccine against colibacteriosis (on the first day of the experiment). The following drugs were tested: "Xymedon" (1-(β-oxyethyl)-4,6-dimethyl-1,2-dihydro-2-oxopyrimidine) was administered intragastrically at a dose of 75 mg/kg daily; "Dimephosphone" (Dimethyloxobuthylphosphonilmethylate)  at a dose of 90 mg/kg daily; “Levamisole” (S)-2,3,5,6-Tetrahydro-5-phenylimidazo[2,1-b]thiazole hydrochloride) intragastrically at a dose of 4 mg/kg for the first 3 days, after a 4-day break it was administered again for 3 days; "Thymalin" (thymus extract derived from thymus glands of large animals) administered intramuscularly at a dose of 0.2 mg/kg for 5 days from 7th day of the experiment. All experimental animals were immunized with the vaccine against colibacteriosis; the vaccine was administered intramuscularly into the back of the thigh at a dose of 0.5 ml per day. The criteria for evaluating the effectiveness of the drugs were hematological indicators, immunological indicators and accumulation of specific antibodies to the vaccine. It has been established that all the tested drugs had a protective effect which was expressed in positive changes in hematological, immunological and non-specific resistance indicators. “Thymalin" had the most pronounced protective effect in toxicosis with T-2 toxin in rats, "Xymedon" had the least protective effect, "Dimephosphone” had an average level of effect. "Thymalin" proved to be more effective according to the indicators of the accumulation of specific antibodies.

Plant susceptibility to pathogens is usually considered from the perspective of the loss of resistance. However, susceptibility cannot be equated with plant passivity since active host cooperation may be required for the pathogen to propagate and cause disease. This cooperation consists of the induction of reactions called susceptible responses that transform a plant from an autonomous biological unit into a component of a pathosystem. Induced susceptibility is scarcely discussed in the literature (at least compared to induced resistance) although this phenomenon has a fundamental impact on plant-pathogen interactions and disease progression. This review aims to summarize current knowledge on plant susceptible responses and their regulation. We highlight two main categories of susceptible responses according to their consequences and indicate the relevance of susceptible response-related studies to agricultural practice. We hope that this review will generate interest in this underestimated aspect of plant-pathogen interactions.

New 3D Ni and Co redox-active metal-organic frameworks based on ferrocenyl diphosphinate and 4,4'-bipyridine ligands have been synthesized, characterized by single crystal X-ray diffraction and spectroscopic techniques and explored as stable electrocatalysts capable of meeting two important parameters: the overpotential and Tafel slope (TS) in the hydrogen evolution reaction (HER). The electrochemical studies suggest that the reaction kinetics of a Ni-MOF (1) catalyst is more favorable than that of a Co-MOF (2) catalyst. Particularly, Ni-MOF exhibits better HER performance with an overpotential of 350 mV at a current density of 10 mA cm-2, a small TS of 60 mV dec-1 and superior long-term durability (of up to 10 000 cycles), ranking it among the most active non-noble metal-based molecular electrocatalysts. The introduction of a 4,4'-bpy linker in 2 significantly changes the catalytic properties in an organic or aqueous environment compared to 1D cobalt polymers based on ferrocenyl diphosphinate. For Co-MOF 2, there is a significant decrease in the overvoltage by ∼440 mV in comparison with the 1D Co polymer in an organic medium and by 50 mV in an aqueous medium. The TS changes from 120 to 65 mV dec-1 when moving from 1D CofcdHp to a 3D structure of 2. Thus, a 4,4'-bpy linker reduces the overvoltage and gives more favorable HER kinetics (lower TS). These results provide important guidelines for the rational design of non-precious metal electrocatalysts.

Using the spin switch design F1/F2/S theoretically proposed by Oh et al., [Appl. Phys. Lett. 71, 2376 (1997)], that comprises a ferromagnetic bilayer as a ferromagnetic component, and an ordinary superconductor as the second interface component, we have realized a full spin switch effect for the superconducting current. An experimental realization of this spin switch construction was achieved for the CoOx/Fe1/Cu/Fe2/In multilayer.

Color centers in diamonds have shown promising potential for luminescent thermometry. So far, the nitrogen-vacancy (NV) color center has demonstrated a high sensitivity for optical temperature monitoring in biological systems. However, the NV center requires microwave excitation which can cause unwanted heating, and the NV is also sensitive to non-axial magnetic fields, both of which can result in inaccurate temperature measurements. To overcome this drawback, the silicon-vacancy (SiV) and germanium-vacancy (GeV) color centers in diamonds have recently been explored and have shown good optical temperature sensitivity owing to the temperature dependent wavelength optical zero-phonon line. Here, we report optical temperature measurements using the recently discovered tin-vacancy (SnV) color center in diamond and show sensitivity better than 0.2 K in 10 s integration time. Also, we compare the relative merits of SnV with respect to SiV and GeV for luminescent thermometry. These results illustrate that there are likely to be many future options for nanoscale thermometry using diamonds.

The bacterial pathogen Yersinia pestis gave rise to devastating outbreaks throughout human history, and ancient DNA evidence has shown it afflicted human populations as far back as the Neolithic. Y. pestis genomes recovered from the Eurasian Late Neolithic/Early Bronze Age (LNBA) period have uncovered key evolutionary steps that led to its emergence from a Yersinia pseudotuberculosis-like progenitor; however, the number of reconstructed LNBA genomes are too few to explore its diversity during this critical period of development. Here, we present 17 Y. pestis genomes dating to 5,000 to 2,500 y BP from a wide geographic expanse across Eurasia. This increased dataset enabled us to explore correlations between temporal, geographical, and genetic distance. Our results suggest a nonflea-adapted and potentially extinct single lineage that persisted over millennia without significant parallel diversification, accompanied by rapid dispersal across continents throughout this period, a trend not observed in other pathogens for which ancient genomes are available. A stepwise pattern of gene loss provides further clues on its early evolution and potential adaptation. We also discover the presence of the flea-adapted form of Y. pestis in Bronze Age Iberia, previously only identified in in the Caucasus and the Volga regions, suggesting a much wider geographic spread of this form of Y. pestis. Together, these data reveal the dynamic nature of plague’s formative years in terms of its early evolution and ecology.

We present a comprehensive experimental and theoretical study of the electronic and magnetic properties of two quasi-two-dimensional (2D) honeycomb lattice monoclinic compounds ${A}_{3}\mathrm{N}{\mathrm{i}}_{2}\mathrm{Sb}{\mathrm{O}}_{6}\phantom{\rule{0.16em}{0ex}}(A=\mathrm{Li},\phantom{\rule{0.16em}{0ex}}\mathrm{Na})$. Magnetic susceptibility and specific heat data are consistent with the onset of antiferromagnetic long-range order with N\'eel temperatures of \ensuremath{\sim}14 and 16 K for $\mathrm{L}{\mathrm{i}}_{3}\mathrm{N}{\mathrm{i}}_{2}\mathrm{Sb}{\mathrm{O}}_{6}$ and $\mathrm{N}{\mathrm{a}}_{3}\mathrm{N}{\mathrm{i}}_{2}\mathrm{Sb}{\mathrm{O}}_{6}$, respectively. The effective magnetic moments of $4.3\phantom{\rule{0.16em}{0ex}}{\ensuremath{\mu}}_{\mathrm{B}}/\mathrm{f}.\mathrm{u}.\phantom{\rule{0.16em}{0ex}}(\mathrm{L}{\mathrm{i}}_{3}\mathrm{N}{\mathrm{i}}_{2}\mathrm{Sb}{\mathrm{O}}_{6})$ and $4.4\phantom{\rule{0.16em}{0ex}}{\ensuremath{\mu}}_{\mathrm{B}}/\mathrm{f}.\mathrm{u}.\phantom{\rule{0.16em}{0ex}}(\mathrm{N}{\mathrm{a}}_{3}\mathrm{N}{\mathrm{i}}_{2}\mathrm{Sb}{\mathrm{O}}_{6})$, where f.u. is formula units, indicate that $\mathrm{N}{\mathrm{i}}^{2+}$ is in a high-spin configuration ($S=1$). The temperature dependence of the inverse magnetic susceptibility follows the Curie-Weiss law in the high-temperature region and shows positive values of the Weiss temperature, $\ensuremath{\sim}8\phantom{\rule{0.16em}{0ex}}\mathrm{K}$ ($\mathrm{L}{\mathrm{i}}_{3}\mathrm{N}{\mathrm{i}}_{2}\mathrm{Sb}{\mathrm{O}}_{6}$) and \ensuremath{\sim}12 K ($\mathrm{N}{\mathrm{a}}_{3}\mathrm{N}{\mathrm{i}}_{2}\mathrm{Sb}{\mathrm{O}}_{6}$), pointing to the presence of nonnegligible ferromagnetic interactions, although the system orders antiferromagnetically at low temperatures. In addition, the magnetization curves reveal a field-induced (spin-flop type) transition below ${T}_{\mathrm{N}}$ that can be related to the magnetocrystalline anisotropy in these systems. These observations are in agreement with density functional theory calculations, which show that both antiferromagnetic and ferromagnetic intralayer spin exchange couplings between $\mathrm{N}{\mathrm{i}}^{2+}$ ions are present in the honeycomb planes, supporting a zigzag antiferromagnetic ground state. Based on our experimental measurements and theoretical calculations, we propose magnetic phase diagrams for the two compounds.

The review describes all the quinoxaline-benzimidazole rearrangements as a whole and the new quinoxalinone-benzimidazol(on)e rearrangements in particular when exposed to nucleophilic rearrangements which can be used for the synthesis of various biheterocyclic motifs.

Superconductor-ferromagnet ($S/F$) spin valve effect theories based on the $S/F$ proximity phenomenon assume that the superconducting transition temperature ${T}_{c}$ of $F1/F2/S$ or $F1/S/F2$ trilayers for parallel magnetizations of the F1 and F2 layers (${T}_{c}^{P}$) are smaller than for the antiparallel orientations (${T}_{c}^{\mathrm{AP}}$). Here, we report for ${\mathrm{CoO}}_{x}/\mathrm{Fe}1/\mathrm{Cu}/\mathrm{Fe}2/\mathrm{In}$ multilayers with varying Fe2-layer thickness the sign-changing oscillating behavior of the spin valve effect $\ensuremath{\Delta}{T}_{c}={T}_{c}^{\mathrm{AP}}\ensuremath{-}{T}_{c}^{P}$. We observe the full direct effect with ${T}_{c}^{\mathrm{AP}}>{T}_{c}^{P}$ for Fe2-layer thickness ${d}_{\mathrm{Fe}2}<1\text{ }\text{ }\mathrm{nm}$ and the full inverse (${T}_{c}^{\mathrm{AP}}<{T}_{c}^{P}$) effect for ${d}_{\mathrm{Fe}2}\ensuremath{\ge}1\text{ }\text{ }\mathrm{nm}$. Interference of Cooper pair wave functions reflected from both surfaces of the Fe2 layer appear as the most probable reason for the observed behavior of $\ensuremath{\Delta}{T}_{c}$.

Rational design and synthesis of efficient metal-organic frameworks (MOFs) as electrode modifiers for energy-related electrocatalytic applications are crucial for the development of clean-energy technologies. The present review focuses on recent work on robust earth-abundant heterogeneous catalysts based on pristine MOFs for the hydrogen evolution reaction (HER) and overall water splitting. These catalysts have been extensively studied as alternatives for noble metal-based ones, demonstrating "hydrogen economy" development prospects. In addition, novel strategies to enhance the conductivity, chemical stability and efficiency of MOF-based electrocatalysts are discussed. The best electrocatalysts even surpass the achievements of the platinum group of metals and MOF-derived catalysts in catalytic performance. The electrolytic cells with MOF-modified electrodes demonstrated excellent catalytic activity and can deliver a high current density at a voltage lower than that using the precious metal-based Pt/C cathodes and IrO2 anodes. In this review article, current approaches to design such MOF and MOF-modified electrode materials are summarized and analyzed.