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Giant Enhancement of Optical Second Harmonic in Poled Glasses by Cold Repoling
The Journal of Physical Chemistry Letters. 2022. Vol. 13. No. 25. P. 5932–5937.
For the first time, we demonstrated that additional poling at room temperature (cold repoling) of a soda-lime glass thermally poled in open anode configuration causes an increase of the optical second harmonic signal by more than an order of magnitude. Performed experiments allow relating this increase in the optical nonlinearity of the glass to the orientation of hydrogenated dipoles in the vicinity of the glass surface. This indicates that both frozen electric field and dipole orientation are responsible for the nonlinearity of thermally poled alkali-containing glasses. Observed dipole orientation in glasses is of interest for molecular physics and electrodynamic studies.
Singapore: Springer Singapore, 2026.
This volume presents the Proceedings of the 34th IUPAP Conference on Computational Physics (CCP2023), held in Kobe, Japan on August 4–8, 2023. It offers a collection of peer-reviewed articles that highlight recent developments in computational and simulation research across various areas of physics. Key topics include the use of data science, quantum computing, and machine ...
Added: October 12, 2026
Goncharov A., Chibisov A., Advanced Theory and Simulations 2023 Vol. 12 No. 13 Article 2200816
Designing stable quantum computers with the ability to correct errors responsibly requires a detailed understanding of the physical processes that underlie these devices. In this study, detailed quantum mechanical simulations of the atomic structure, charge distribution of electron density, and distribution and orientation of magnetic and quantum states as a function of applied external pressure ...
Added: October 11, 2026
Chibisov A., Gnidenko A., Chibisova M. et al., FlatChem 2023 Vol. 41 Article 100533
Manufacturing precise quantum computers with small errors in quantum operations, long coherence times, and low power consumption is the most important challenge in modern nanoelectronics. To understand the operating modes of such calculators in detail, both the optimal arrangement of the qubit system within the structure and changes in its magnetic properties must be comprehensively ...
Added: October 11, 2026
Wu Z., Yu Y., Chibisov A., Materials Today Energy 2023 Vol. 37 Article 101414
The limited availability of lithium metal resources has led to the development of sodium/potassium-ion batteries due to the abundance and low cost of sodium/potassium. However, finding suitable cathode materials with high capacity, stable cycling performance, and efficient electrochemical interface is still challenging. Herein, the honeycomb layered structures of P2-type A2Ni2TeO6 (A = Na, K) have been explored ...
Added: October 11, 2026
Shi R., Yu Y., Chibisov A., International Journal of Hydrogen Energy 2025 Vol. 107 P. 52–62
Cyanide containing wastewater can cause livestock death and reduce agricultural production and electrochemical reduction of cyanide (CNRR) is a promising way to eliminate its harm and turn waste into valuable products. However, the reaction mechanism and function of electrocatalysts for CNRR have not been fully understood yet. Herein we identify a two-dimensional (2D) conductive copper-organic ...
Added: October 11, 2026
Prokhorenko A., Chibisov A., Gnidenko A. et al., The Journal of Physical Chemistry Letters 2024 Vol. 15 No. 41 P. 10295–10300
The development of ultrathin magnets with tunable magnetic properties is essential for advancing quantum computing technologies. In this study, density functional theory (DFT) calculations were employed to investigate the atomic and electronic structures of a ZnO monolayer embedded with cobalt atoms. The impact of spin dynamics on charge transfer within the Co:ZnO system was thoroughly ...
Added: October 11, 2026
Chibisov A., Chibisova M., Modern Electronic Materials 2025 Vol. 71 P. 99–103
The problem of creating energy-efficient quantum computers capable of performing quantum operations without errors is a significant scientific challenge in modern nanoelectronics. This type of computer can be developed using quantum transistors that contain hole qubits and are capable of performing operations on them. Hole qubits are a promising technology for quantum computers due to ...
Added: October 11, 2026
Tyagi V., Srivastava A., Mangal A. et al., Surfaces and Interfaces 2025 Vol. 73 Article 107591
The present work reports the suitability of Functionalized graphene sheet as a sensing material for detecting the diabetes biomarker acetone from Exhaled breath. The adsorption of Acetone on Boron/Nitrogen doped graphene sheet has been investigated using the Density Functional theory (DFT). The interaction between acetone and the graphene surface has been investigated in terms of ...
Added: October 11, 2026
Bulakh S., Chibisov A., Srivastava A., Russian Microelectronics 2026 Vol. 55 P. 311–315
The effect of sulfur vacancies on the electronic structure of a molybdenum disulfide (MoS2) monolayer has been studied using density functional theory (DFT) methods implemented in the VASP software package. The ideal structure and systems with one and two sulfur vacancies and various options of defect localization in the MoS2 structure have been discussed. A ...
Added: October 11, 2026
Vangapandu E., Agrawal S., Kumar S. et al., Materials Science in Semiconductor Processing 2026 Vol. 211 Article 110752
Silicides are widely used as local interconnects in integrated circuits (ICs); thus, their nanostructures shall enjoy significant process compatibility with the IC technology. This work reports the utilization of Gold (Au), copper (Cu), and aluminium (Al)-based mono-silicide nanotubes (zig-zag (ZZ) and armchair (AC)) for nanoscale interconnect applications, through a material-device-circuit co-modelling approach. These nanotubes exhibit ...
Added: October 10, 2026
Ozhegov R., Махлуф М., Goltsman G. et al., Инженерная физика 2026 № 8 С. 27–39
This paper investigates the theoretical limits of object detection within isotropic scattering media using single-photon lidar. Within a simplified model, we derive the fundamental relationship between the maximum attainable detection range and the required photon count per pulse. Two distinct limiting regimes are analyzed: the ballistic photon regime, which maintains high spatial resolution but necessitates ...
Added: October 8, 2026
Didenkulova E., Chugunov V., Didenkulova I., Wave Motion 2026 Vol. 147 Article 103787
This work presents a new analytical solution of the shallow water theory for cylindrical propagation of long tsunami-like waves in the basin of variable depth. Considered model cases are related to tsunami wave propagation from an asteroid fallen into the sea, or from underwater volcanic eruptions. The corresponding bottom geometries represent radially symmetric obstacles such ...
Added: October 8, 2026
Flamarion M., Didenkulova E., Pelinovsky E., Physics Letters A 2026 Vol. 598 Article 132218
In this letter, bipolar solitary wave interactions in the Schamel equation are revisited numerically. Two simulation settings are considered: repeated collisions in a periodic domain, and the interaction of a positive solitary wave with a train of negative polarity solitary waves of equal amplitude. In the first case, when the amplitudes are comparable, the larger ...
Added: October 8, 2026
Isaev T. F., Шаров А. Н., Журнал вычислительной математики и математической физики 2026 Т. 66 № 1 С. 83–93
Исследуются свойства оптических покрытий на основе использования упрощенного симулятора ошибок в толщинах слоев покрытий при их напылении. Обосновывается возможность такого подхода. Выводятся аналитические оценки среднеквадратичного значения нормы вектора ошибок и степени коррелированности ошибок в толщинах слоев покрытия. Изучается зависимость среднеквадратичного значения нормы вектора ошибок и свойств покрытия от уровня случайных ошибок в слоях. ...
Added: October 5, 2026
Осипова А. М., Пилипенко С. В., Novikov D. I. et al., Physical Review D - Particles, Fields, Gravitation and Cosmology 2026 Vol. 114 Article 063522
We investigate the prospects for observing a specific spectral distortion of the cosmic microwave
background, which occurs due to the anisotropy of the radiation when it is scattered by hot plasma of
galaxy clusters. Detection of this anisotropic Sunyaev-Zel’dovich effect would enable an independent
measurement of the CMB anisotropy multipoles with l 1⁄4 1, 2, 3, allow the ...
Added: October 5, 2026
Gribova N. I., Osmanov S. V., Lyashko S. D. et al., Journal of Magnetism and Magnetic Materials 2025 No. 614 P. 1–8
Here we demonstrate nanometer thick iron garnet films with high specific Faraday rotation suitable for
the magneto-optical applications. Bismuth-substituted iron garnet films of compositions Bi1Y2Fe5O12 and
Bi1Tm2Fe5O12 deposited on gadolinium gallium garnet substrate are fabricated and characterized. Their
thicknesses range from 2 to 10 nm, which corresponds to just a few crystal lattice constants. Spectacularly,
Faraday rotation of the ...
Added: October 4, 2026
Seleznev G., Fominov Yakov V., Physical Review B: Condensed Matter and Materials Physics 2026 Vol. 114 No. 7 Article 074505
Dirty superconducting films with magnetic impurities can exhibit nontrivial behavior in a magnetic field that
polarizes the impurity spins. As predicted by Kharitonov and Feigelman (KF) [JETP Lett. 82, 421 (2005)],
this polarization reduces the exchange scattering rate. Consequently, a parallel magnetic field can enhance
the critical temperature Tc when magnetic-field pair breaking is weak, as realized for ...
Added: October 2, 2026
Zhukov A., Chen F., Zeng Y. et al., Nanoscale 2026 Vol. 18 No. 36 P. 19223–19253
Colloidal semiconductor nanocrystals have emerged as promising materials for next-generation light-emitting diodes (LEDs) owing to their solution processability, tunable emission wavelengths, narrow emission linewidths, and high photoluminescence quantum yields. Among them, anisotropic nanocrystals, including one-dimensional nanorods (NRs) and two-dimensional nanoplatelets (NPLs), offer additional opportunities for controlling transition dipole moment orientation and light out-coupling efficiency. These ...
Added: October 2, 2026
Vanhaelen Q., Lin Y., Zhavoronkov A., ACS Medicinal Chemistry Letters 2020 Vol. 11 No. 8 P. 1496–1505
Generative adversarial networks (GANs), first published in 2014, are among the most important concepts in modern artificial intelligence (AI). Bridging deep learning and game theory, GANs are used to generate or “imagine” new objects with desired properties. Since 2016, multiple GANs with reinforcement learning (RL) have been successfully applied in pharmacology for de novo molecular design. Those ...
Added: June 1, 2026
Medvedev M., Journal of Chemical Information and Modeling 2025 Vol. 65 No. 12
Added: November 12, 2025
Сень В. Д., Филатова Н. В., Шилов Г. В. et al., Известия РАН. Серия химическая 2023 Т. 72 № 7 С. 1680–1687
New platinum(IV)-aminoxyl complexes (PAC) 2a,b have been synthesized, containing aminoxyl radical with antioxidant properties in one of equatorial position, and axial ligands are represented by dichloroacetate, capable of inhibiting energy production through glycolysis in tumor cells. Complexes 2a,b are characterized by moderate lipophilicity (lg Pow ~2) and differ in the redox properties of aminoxyls. Cytotoxic ...
Added: September 14, 2025
Dmitriev A. Y., Vasenin A. V., Gunin S. A. et al., Physical Review A: Atomic, Molecular, and Optical physics 2025 Vol. 111 No. 4 Article 043715
A cascade of two-level superconducting artificial atoms—a source and a probe—strongly coupled to a semi-infinite waveguide is a promising tool for observing nontrivial phenomena in quantum nonlinear optics. The probe atom can scatter an antibunched radiation emitted from the source, thereby generating a field with specific properties. We experimentally demonstrate wave mixing between nonclassical light ...
Added: June 21, 2025
Melnikov A., A. A. Sokolik, Selivanov Y. G. et al., Journal of Applied Physics 2025 Vol. 137 No. 16 Article 163104
We report the observation of the electro-optic effect in Bi2Se3 crystals induced by an intense single-cycle terahertz pulse. The effect reveals itself as a transient change of the polarization state of a femtosecond laser pulse reflected from the crystal that is exposed to the terahertz electric field. The corresponding experimental signal follows the field with ...
Added: April 24, 2025
Laurinavichyute V., Nizamov S., Mirsky V. M., Analytical Chemistry 2025 Vol. 97 No. 2 P. 1160–1169
Single nanoparticle (NP) cyclic voltarefractometry (CVR), realized as wide-field surface plasmon resonance microscopy (SPRM) in combination with potential cycling, has been proposed and applied to the in situ study of TiO2 NPs. Electrochemical activity of TiO2 is mainly observed outside the electrochemical stability window of water. Therefore, the response of individual anatase (a-TiO2) and rutile (r-TiO2) NPs ...
Added: January 21, 2025