Search Results (338)

In ultrafast science, the strong-field approximation (SFA) provides a powerful framework to describe high-order harmonic generation (HHG) and related phenomena. Meanwhile, within the current ab initio theoretical framework, the use of nonlocal potentials in calculating multi-electron molecular wave functions is almost unavoidable. We find that when such wave functions are directly applied to compute transition dipole moments for correcting SFA, it introduces a fundamental gauge transformation problem. Specifically, the nonlocal potential contributes an additional gauge-dependent phase function to the dipole operator, which directly modifies the phase of the transition dipole. As a consequence, the saddle-point equations acquire an entirely different structure compared to the standard SFA, leading to a splitting of the conventional short and long classical trajectories in HHG into multiple distinct quantum trajectories. Here, “complex molecules” refers to multi-center molecular systems whose nonlocal electronic structure leads to gauge-dependent strong-field responses. Our analysis highlights that the validity of gauge in-variation cannot be assumed universally in SFA framework. Our approach combines the molecular strong-field approximation with gauge transformation analysis, incorporating nonlocal pseudopotentials, saddle-point equations, and multi-center recombination effects. Full article

Humidity monitoring is essential in industrial and scientific scenarios, yet remains challenging for compact EMI (electromagnetic interference)-immune sensors with high sensitivity and robust stability. A novel fiber Bragg grating (FBG) humidity sensor was developed, which incorporated LiCl@UIO-66 microfillers within a poly(N-isopropylacrylamide) (PNIPAM) hydrogel matrix. Structural characterization using X-ray diffraction (XRD), scanning electron microscopy (SEM), energy-dispersive X-ray spectroscopy (EDS), and Fourier-transform infrared (FTIR) spectroscopy confirms that LiCl is confined or nanodispersed within intact UIO-66, and that interfacial ion–dipole/hydrogen-bonding exists between the composite and water. Systematic variation in coating time (30–720 min) reveals monotonic growth of the total wavelength shift with diminishing returns. A coating time of 4 h was found to yield a wavelength shift of approximately 0.38–0.40 nm, representing about 82% of the maximum shift observed at 12 h, while maintaining good quasi-linearity and favorable kinetics. Calibration demonstrates sensitivities of 6.7 pm/%RH for LiCl@UIO-66_33 and 10.6 pm/%RH for LiCl@UIO-66_51 over ~0–95%RH. Stepwise tests show response times t90 of ≈14 min for both composites, versus ≈30 min for UIO-66 and ≈55 min for neat PNIPAM. Long-term measurements on the 51 wt.% device are stable over the first ~20 days, with only slow drift thereafter, and repeated humidity cycling is reversible. The wavelength decreases monotonically during drying while settling time increases toward low RH. The synergy of hydrogel–MOF–salt underpins high sensitivity, accelerated transport, and practical stability, offering a scalable route to high-performance optical humidity sensing. Full article

Background/Objectives: Cardiac resynchronization therapy with defibrillator (CRT-D) is a well-established therapy for patients with heart failure (HF) and intraventricular conduction delays, but a non-negligible risk of infection and of lead functionality loss overtime is related to intravascular hardware. The novel DX system enables atrial sensing through a floating dipole integrated into the ICD lead, reducing the intravascular burden. In this prospective non-randomized study, we aimed to evaluate the safety and efficacy of a two-lead DX-based CRT system compared to a conventional three-lead (3L) CRT-D system. Methods: A total of 210 patients meeting CRT indications and no signs of sick sinus syndrome (SSS) (baseline HR ≥ 45 bpm, or at least 85 bpm at 6 min walking test) were enrolled. Patients were assigned to either the CRT-DX or conventional 3L CRT-D group. The primary endpoint was a composite clinical response, defined as the freedom from cardiovascular death, HF hospitalization, or new-onset atrial fibrillation (AF). Results: After a mean follow-up of 46.5 ± 1.9 months, both groups had comparable clinical and instrumental outcomes. CRT-DX patients exhibited higher atrial sensing amplitudes and no significant differences in loss of lead function. Conclusions: In conclusion, the CRT-DX system provides equivalent clinical and echocardiographic benefits compared to conventional CRT-D in patients without an indication for atrial pacing. This supports the use of the DX system as a safe and effective alternative in the majority of CRT recipients. Full article

We present a comprehensive computational study of the UV-visible absorption spectra of 7-methoxycoumarin and Nile red in aqueous solution. Our fully atomistic workflow couples classical molecular dynamics (MD) with polarizable QM/MM based on fluctuating charges (QM/FQ) and dipoles (QM/FQF$\mu$). Ensemble-averaged spectra are constructed from the snapshots extracted from the MD, embedding solvent fluctuations and specific solute–solvent interactions in the electronic response of organic dyes. The spectral profiles, obtained at the various levels, reflect the underlying solute–solvent interactions and dynamics, and we rationalize them in terms of hydrogen bonding and frontier molecular orbitals involved in the main electronic transitions. Finally, the simulated spectra and solvatochromic shifts are compared with the available experimental data, showing an overall good agreement and demonstrating the robustness of the computational protocol. Full article

A statistical study is conducted to understand how the Mascarene High (MH) of the southwest Indian Ocean affects the springtime climate of southeastern Africa, in response to global teleconnections. A temporal index of sea-level air pressure is formed and correlated with large-scale fields of sea temperature, winds, and rainfall in the period 1980–2024. The results suggests that the MH tends to intensify and shift westward during Pacific El Niño conditions via a standing wave train in the subtropical jet stream over the South Atlantic. As this happens, anticyclonic airflow draws moisture from the Mozambique Channel and drives it onto the Kalahari plateau via low-level jets over the Limpopo and Zambezi River valleys. The Sep–Nov rainfall increases ~1 mm/day across southern Africa, accompanied by cooler temperatures and lower potential evaporation. So the spring season starts with a smaller water deficit that could favor early-planted, short-cycle crops. Outstanding questions remain on the stability of Pacific teleconnections and coupling with the Indian Ocean Dipole. Full article

This paper presents a dual-polarized millimeter-wave filtering antenna based on a broadband partially reflective surface lens for gain improvement. It consists of a magneto-electric dipole (M-E dipole) as the source and a partially reflective surface (PRS) as the lens. The M-E dipole source antenna employs a dual-layer substrate structure, and its working principle is investigated by the circuit analysis method. A stub-loaded transmission line network is used to study the radiation characteristics of the source antenna, and the simulation results reveal that it has intrinsic integrated bandpass-type filtering response. The PRS lens is realized by designing a square high permittivity superstrate. By combining the source antenna and the lens, a wideband dual-polarized high gain cavity antenna is developed. The fabricated prototype has a measured impedance bandwidth of 33.3% (25–35 GHz), and a maximum in-band gain of 12.3 dBi. Above features make the proposed antenna a good candidate for 5G millimeter-wave sensor applications. Full article

Giant dielectric oxides are attractive for next-generation capacitors and related applications, but their practical use is limited by high loss tangent (tanδ), strong temperature dependence of dielectric permittivity (ε′), and the need for energy-intensive high-temperature sintering. To address these challenges, this study focuses on the development of (In_0.5Ta_0.5)_xTi_1−xO₂ (ITTO, x = 0.02–0.06) ceramics via a green egg-white solution route, targeting high dielectric performance at reduced processing temperatures. The as-calcined powders exhibited the anatase TiO₂ phase with particle sizes of ~20–50 nm. These powders promoted densification at a sintering temperature of 1300 °C, significantly lower than those of conventional co-doped TiO₂ systems. The resulting ceramics exhibited refined grains, high relative density, and homogeneous dopant incorporation, as confirmed by XRD, SEM/TEM, EDS mapping, and XPS. Complementary density functional theory calculations were performed to examine the stability of In³⁺/Ta⁵⁺ defect clusters and their role in electron-pinned defect dipoles (EPDDs). The optimized ceramic (x = 0.06, 1300 °C) achieved a high ε′ of 6.78 × 10³, a low tanδ of 0.038, and excellent thermal stability with Δε′ < 3.9% from 30 to 200 °C. These results demonstrate that the giant dielectric response originates primarily from EPDDs associated with Ti³⁺ species and oxygen vacancies, in agreement with both experimental and theoretical evidence. These findings emphasize the potential of eco-friendly synthesis routes combined with rational defect engineering to deliver high-performance dielectric ceramics with reliable thermal stability at reduced sintering temperatures. Full article

This study proposes a semi-analytic harmonic modeling method that significantly improves the accuracy and efficiency of complex magnetic field modeling by integrating numerical and analytical approaches. Compared to traditional methods such as the equivalent charge method and finite element method, this approach optimizes the distribution of surface and body charges in the magnetic dipole model and introduces a finite and variable permeability model to accommodate material non-uniformity. Through harmonic expansion and analytical optimization, the method more accurately reflects the characteristics of real magnets, providing an efficient and precise solution for complex magnetic field problems, particularly in the design of high-performance magnets such as Halbach arrays. In this study, the effectiveness of the new modeling method is verified through the combination of simulation and experiment: the magnetic field distribution of the new Halbach array is accurately simulated, and the applicability of the model in the description of complex magnetic fields is analyzed. The dynamic response ability of the optimized model is verified by modeling and simulating the variation of the permeability under actual conditions. The distribution of scalar potential energy with permeability was simulated to evaluate the adaptability of the model to the real physical field. Through the comparative analysis of simulation and experimental results, the advantages of the new method in modeling accuracy and efficiency are clearly pointed out, and the effectiveness of the semi-analytic harmonic modeling method and its wide application potential in the design of new magnetic fields are proved. In this study, a semi-analytic harmonic modeling method is proposed by combining numerical and analytical methods, which breaks through the efficiency bottleneck of traditional modeling methods, and achieves the unity of high precision and high efficiency in the magnetic field modeling of the new Halbach array, providing a new solution for the study of complex magnetic field problems. Full article

Longitudinal shifts in the zonal dipole associated with the El Niño–Southern Oscillation (ENSO) in the tropical Pacific have implications for the summer climate of Southern Africa. These features are studied via Empirical Orthogonal Function analysis applied to monthly standardized sea temperatures from 1 to 100 m in depth and spanning 1980–2024. The dipole exhibits two modes: central and east Pacific. The central mode has 4–7 yr oscillations, while the east mode has a periodicity of 3 yr and 8–14 yr, with a trend toward La Niña. Correlations are mapped with environmental fields around Southern Africa. During east-mode La Niña, there are low-level westerlies over the Kalahari Plateau that coincide with a warm-west Indian Ocean and neutral summer (Dec–Mar) weather conditions over Southern Africa. The weak climatic response across the Atlantic–Indian basins during east Pacific La Niña is linked to an isolated Walker cell that feeds tropical moisture into a trough over the dateline (180° W). It is the central mode that has greater influence over Southern Africa, by triggering global Walker cells that link with the Indian Ocean Dipole. Full article

We theoretically demonstrate that nonmagnetic silicon nanodisk dimers, under plane-wave illumination, can achieve electric dipole mode-free by suppressing electric dipole responses at magnetic resonance frequencies through structural parameter tuning. This is enabled by the anapole mode, where destructive interference between Cartesian electric and toroidal dipole moments results in low spherical electric dipole scattering. Furthermore, the magnetic resonance responses in this nanostructure are tunable within the visible spectrum and compatible with current nanofabrication technology. Full article

To address the technical challenges in dynamic monitoring of grout diffusion patterns under complex geological conditions, in this study, a distributed parallel grouting monitoring system based on electrical resistivity tomography was developed. The system achieves three-dimensional visualization of grout propagation through hardware architecture innovation and the integration of inversion algorithms. At the hardware level, a cascadable distributed data acquisition terminal was designed, employing a dynamic optimization strategy for electrode combinations. This breakthrough overcomes traditional serial acquisition limitations. Algorithmically, a Bayesian estimation-based geological unit merging inversion model was proposed; it dynamically calculates merging thresholds through the noise posterior probability, achieving an improvement of more than 30% in the inversion boundary resolution compared with traditional least squares methods. Numerical simulations and physical experiments demonstrated that dipole arrays with 0.5 m electrode spacing exhibit optimal sensitivity to variations in grout resistivity, accurately capturing electrical response characteristics during diffusion. In practical roadbed grouting applications, the system yielded a grout diffusion radius showing only a 0.3 m deviation from the core sampling verification results, with three-dimensional imaging clearly depicting the diffusion morphology. This system provides reliable technical support for the precise control and quality assessment of underground engineering grouting processes. Full article

The ferroaxial moment, a time-reversal-even axial dipole degree of freedom, plays a key role not only in conventional quantum states of matter but also in anomalous off-diagonal cross-correlated responses. Here, we theoretically demonstrate that a skyrmion crystal with a swirling non-coplanar spin texture can exhibit ferroaxiality. In particular, we show that a hybrid skyrmion crystal, formed by the superposition of Néel- and Bloch-type vortices, hosts a finite ferroaxial moment. The degree of ferroaxiality is quantified by calculating the expectation value of the electric toroidal dipole within a multi-orbital tight-binding model based on multipole representation theory. We further reveal characteristic off-diagonal responses associated with magnetic and magnetic toroidal multipoles under external magnetic fields. These results establish the hybrid skyrmion crystal as a promising platform for exploring the fundamental nature of ferroaxial moments. Full article

In this work, the ground and low-lying excited states in a GaAs coupled quantum dot-ring embedded in an AlGaAs cylindrical matrix are computed under the assumption of a finite confinement potential and an axisymmetric model by means of the finite element method and the effective mass approximation. The electron energy levels are studied as functions of the intensity of externally applied electric and magnetic fields. Electromagnetically induced transparency in the ladder configuration and linear optical absorption coefficient are calculated thereupon. Our results suggest that magnetic fields are more suitable than electric fields for controlling the optical properties of this nanostructure. Also, we found that the system’s response, however, exhibits a striking asymmetry: while the electromagnetically induced transparency is unexpectedly quenched under positive electric fields due to vanishing dipole transition matrix elements, this limitation is completely overcome by a magnetic field. Its application not only restores optical transparency across the full range of electric field values but also drives substantially larger energy level shifts and clear Aharonov–Bohm oscillations, making it a far more robust tool for controlling the optical properties of confined electrons in dot-ring coupled heterostructures. Full article

Tropical cyclones (TCs) over the Arabian Sea pose significant threats to coastal populations and result in substantial economic losses, yet their variability in response to major climate modes remains insufficiently understood. This study examines the relationship between the El Niño–Southern Oscillation (ENSO), the Indian Ocean Dipole (IOD), and the Indo-Pacific Warm Pool (IPWP) with TC activity over the Arabian Sea from 1982 to 2021. Utilizing the India Meteorological Department (IMD)’s best-track data, reanalysis datasets, and composite analysis, we find that ENSO and IOD phases affect TC activity differently across seasons. The pre-monsoon season shows a limited association between TC activity and both ENSO and IOD, with minimal variation in frequency, intensity, and energy metrics. However, during the post-monsoon season, El Niño enhances TC intensity, resulting in a higher frequency of intense storms, leading to increased accumulated cyclone energy (ACE) and power dissipation index (PDI) in a statistically significant way. In contrast, La Niña favors the development of weaker TC systems and an increased frequency of depressions. While negative IOD (nIOD) phases tend to suppress TC formation, positive IOD (pIOD) phases are associated with increased TC activity, characterized by longer durations and higher ACE and PDI (statistically significant). Genesis sites shift with ENSO: El Niño favors genesis in the eastern Arabian Sea, causing westward or northeastward tracks, while La Niña shifts genesis toward the central-western basin, promoting northwestward movement. Composite analysis indicates that higher sea surface temperatures (SSTs), reduced vertical wind shear (VWS), increased mid-tropospheric humidity, and lower sea level pressure (SLP) during El Niño and pIOD phases create favorable conditions for TC intensification. In contrast, La Niña and nIOD phases are marked by drier mid-level atmospheres and less favorable SST patterns. The Indo-Pacific Warm Pool (IPWP), particularly its westernmost edge in the southeastern Arabian Sea, provides a favorable thermodynamic environment for genesis and exhibits a moderate positive correlation with TC activity. Nevertheless, its influence on interannual variability over the basin is less significant than that of dominant large-scale climate patterns like ENSO and IOD. These findings highlight the critical role of SST-related teleconnections (ENSO, IOD, and IPWP) in regulating Arabian Sea TC activity, offering valuable insights for seasonal forecasting and risk mitigation in vulnerable areas. Full article

This theoretical work investigates the linear (absorption and emission) and nonlinear (first hyperpolarizability and TPA) optical properties of donor–$\pi$–acceptor (D–$\pi$–A) molecular architectures based on functionalized benzoxazoles, with potential applications in optoelectronic technologies such as OLEDs and solar cells. Four $\pi$-conjugated compounds were studied in the gas phase and in polar (methanol) and nonpolar (toluene) solvents, employing DFT with the B3LYP and CAM-B3LYP functionals and the 6-311++G(d,p) basis set, as implemented in Gaussian and Dalton. The results reveal that the chemical environment induces spectral shifts and modulates the intensity of electronic transitions. In particular, the compound 2-((4-((5-nitro-2-oxo-1,3-benzoxazol-3(2H)-yl)amino)phenyl)methyl)-1,3-benzoxazole exhibited outstanding behavior in methanol, with a significant increase in dipole moment, polarizability, and first hyperpolarizability (static and dynamic at 1064 nm), reaching a TPA cross-section close to 150 GM. These findings highlight the key role of ionic substituents in tuning the optical response of $\pi$-conjugated systems and underscore their potential as functional materials for high-performance light-emitting and energy-conversion devices. Full article