Field Values Research Articles

Unveiling the NLO Potential of New Zn (II) Complex of 6‐Methylpyridine‐2‐Carboxaldehyde: Experimental/DFT Study on Spectral, Static, and Frequency‐Dependent Linear/Nonlinear Optical Parameters

ABSTRACTOngoing exploration focuses on synthesizing and characterizing coordination compounds to improve the design of nonlinear optical (NLO)‐based materials. In this regard, to examine spectral and static/frequency–dependent linear/NLO parameters, the new Zn (II) complex {[Zn(6‐MePyAld)2(Cl)]; 6‐MePyAld: 6‐methylpyridine‐2‐carboxaldehyde} was synthesized and characterized by using 1H and 13C NMR, mass (LC‐HRMS), powder XRD, and FTIR spectra. The electronic features of synthesized complex were investigated by considering the TD‐CAM‐B3LYP/ and TD‐M06L/6‐311G(d,p)//LanL2DZ levels of time‐dependent density functional theory (TD‐DFT). Moreover, the theoretical linear optical (LO), second‐, and third‐order NLO susceptibility tensors/polarization (χ(1)/P(1), χ(2)/P(2), χ(3)/P(3)) parameters for the Zn (II) complex were computed using the DFT/M06L and DFT/CAM‐B3LYP levels. The external electric field (E), polarization (P), and electric displacement (D) values of the Zn (II) complex were also calculated using the same DFT levels. To investigate microscopic LO (isotropic polarizability <α(0;0)>/<α(−ω;ω)>, and anisotropic polarizability (∆α (0;0)/∆α (−ω;ω)) and second‐/third‐order NLO (<β(0;0,0)>/<β(−ω;ω,0), <β(−2ω;ω,ω)>/<γ(0;0,0,0)>/<γ(−ω;ω,0,0)> and <γ(−2ω;ω,ω,0)>) parameters for the Zn (II) complex, the DFT/M06L and DFT/CAM‐B3LYP levels in the gas phase were used. The ∆α (0;0), ∆α (−ω;ω), <β(0;0,0)>, <β(−ω;ω,0)>, and <β(−2ω;ω,ω)> for Zn (II) complex were computed at 17.288 × 10−24, 21.782 × 10−24, 14.692 × 10−30, 466.80 × 10−30, and 210.79 × 10−30 esu, respectively, by using the DFT/CAM‐B3LYP level. Moreover, the <γ(0;0,0,0)>/<γ(−ω;ω,0,0)> and <γ(−2ω;ω,ω,0)> in the gas phase computed at the DFT/CAM‐B3LYP level for Zn (II) complex were obtained at 129.74 × 10−36, 3997.6 × 10−36, and −886.60 × 10−36 esu, in turn. According to the CAM‐B3LYP level, the <γ(0;0,0,0)> value is 8.65 and 18.53 times higher than the values of para‐nitroaniline (pNA) and urea, respectively. The obtained static/dynamic β and γ values of Zn (II) complex are greater than those of urea and pNA. Zn (II) complex exhibited remarkably microscopic second‐order and particularly third‐order NLO features. It is predicted that our study will shed light on NLO materials that might be used in telecommunication and optoelectronics.

Mechanical performance and prediction of a novel reinforced octagonal honeycomb

Honeycomb structures are widely used in various engineering applications due to their lightweight and excellent energy absorption capabilities. Materials with two plateau stress regions exhibit unique advantages in multi-stage energy dissipation and multi-task applications. This paper presents a reinforced octagonal honeycomb structure (ROHC) inspired by the topology of an octagonal tensegrity structures. The paper demonstrates the phenomenon of two plateau deformation stages through the 3D printing of ROHC specimens and finite element simulation. By adjusting three geometric parameters of ROHC (angle α, length ratio r, and thickness t of internal reinforcement), the paper obtains the influence laws on the first and second plateau stress and strain, and proves the controllability of two-stage mechanical performance of ROHC. Based on deep learning technology, a performance prediction model for ROHC's two-stage mechanical performance is proposed, with the MSE and R values confirming the accuracy of the prediction model. Based on the prediction model, a rapid reverse design method is proposed, capable of designing structures with expected two-stage mechanical performance, with errors <7.25 %. The proposed honeycomb structure with predictable and reversible design has significant research value in fields with multi-stage energy absorption and crash protection requirements.

Localized space-time Trefftz method for diffusion equations in complex domains

This paper introduces an advanced localized space-time Trefftz method tackling boundary value predicaments within complex two-dimensional domains governed by diffusion equations. In contrast to the widespread space-time collocation Trefftz method, which typically produces dense and ill-conditioned matrices, the proposed strategy employs a localized collocation scheme to remove these constraints. In particular, this is beneficial in multi-connected configurations or when dealing with significant variations in field values. To the best of our knowledge, this is the first space-time collocation Trefftz method adaptation, which is referred to as the localized space-time Trefftz method in this paper. The latter combines the space-time collocation Trefftz method principles, which allows to eliminate the need for mesh and numerical quadrature in its application. The localized space-time Trefftz method represents each interior node expressed as a linear blend of its immediate neighbors, while the space-time collocation Trefftz method applies numerical techniques within distinct subdomains. A sparse system of linear algebraic equations with internal points satisfying the governing equation, and boundary points satisfying the boundary conditions, allows to obtain numerical solutions using matrix systems. The localized space-time Trefftz method retains the easy-to-use properties and mesh-free structure of the space-time collocation Trefftz method, and it mitigates its ill-conditioning characteristics. Due to the localization principle and the consideration of overlapping subdomains, the solutions in the proposed localized space-time Trefftz method are more simply and compactly expressed compared with those in the space-time collocation Trefftz method, especially when dealing with multiply-connected domains. Numerical examples for simply-connected and multiply-connected domains are then provided to demonstrate the high precision and simplicity of the proposed localized space-time Trefftz method. The obtained results show that the latter has very high accuracy in solving two-dimensional diffusion problems. Compared with the traditional space-time collocation Trefftz method, the proposed mesh-free strategy yields solutions with higher precision while significantly reducing the instability.

Improving piezoelectric performance in PMN-0.26 PT single crystal via low frequency AC poling

In this experiment, the alternating current poling (ACP) was applied to the 0.74 Pb(Mg1/3Nb2/3)O3-0.26PbTiO3 (PMN-0.26 PT) single crystal to explore the impact of low frequency (0.1 Hz) ACP on electrical performance. When the poling condition is loading 5 cycles at 14 kV/cm, high piezoelectric coefficient d33 of 1780 pC/N and giant dielectric constant of 5881 are obtained for the ACP treatment sample, enhanced 42.4 % and 14.3 % by contrast with the conventional direct current poling (DCP), respectively. The values of coercive field, maximum strain, and converse piezoelectric constant d33∗ vary considerably around the ferroelectric phase transition detected by polarization-electric field, as well as bipolar and unipolar electric field-induced strain hysteresis loops. In addition, the domain configuration of the ACP sample presents a more periodic stripe-like structure with narrower width and relatively more uniformity after three months aging as compared with the DCP sample, showing the importance of domain engineering in enhancing electrical performance of ferroelectric single crystals.

Spontaneous Formation of Solid Shell Polymeric Multicompartments at All-Aqueous Interfaces.

Multicompartmental capsules have demonstrated value in fields ranging from drug release, mimetics of artificial cells, to energy conversion and storage. However, the fabrication of devices with different compartments usually requires the use of toxic solvents, and/or the adaptation of technically demanding methods, including precision microfluidics and multistep processes. The spontaneous formation of multi-core capsules resulting from polyelectrolyte complexation at the interface of a prototypic all-aqueous two-phase system is described here. The variation of polyelectrolyte concentration and complexation time are described as simple working parameters capable of driving the formation of compartments at different yields, as well as tailoring their morphology. The mild processing technology enables the encapsulation of animal cells, which are capable of invading capsule walls for specific processing conditions.

Numerical experiments on granulation-generated two-fluid waves and flows in a solar magnetic carpet

ABSTRACT We consider the effects of granulation with a complex geometry of a magnetic carpet on the genesis of waves and plasma flows in a quiet-region of the solar atmosphere. Our aim is to perform numerical experiments on the self-generated and self-evolving solar granulation in a magnetic carpet representing the parts of the large-scale magnetized solar atmosphere, where waves and flows are basic inherent physical processes occurring continuously. We perform numerical experiments with the use of the joanna code which solves non-ideal and non-adiabatic two-fluid equations for ions + electrons and neutrals treated as two separate fluids. In these experiments, we assume that the plasma is hydrogen, and initially described by magnetohydrostatic equilibrium which is accompanied with a magnetic carpet. Parametric studies with different values of magnetic field show that its higher values result in larger magnitudes of ion-neutral velocity drift, thus ensuring larger heating and plasma flows. The present model addresses that in the highly dynamic solar chromosphere, waves, heating and plasma flows may collectively couple different layers of the solar atmosphere, and this entire process crucially depends on the local plasma and magnetic field properties. We suggest that waves and flows are the natural response of the granulation process in the quiet-Sun.

AN EXAMINATION OF SOCIAL DOMINANCE ORIENTATION OF GENERATION Z LIVING IN TURKEY ACCORDING TO DIFFERENT VARIABLES

In this study, the social dominance orientations of the generation Z were examined according to different variables (gender identity, view of socio-economic class, occupation field, identity attitudes, purposive and instrumental values). The research sample consists of 640 individuals aged between 19-25 and living in different regions of Turkey. Socio-demographic Information Form, Social Dominance Orientation Scale, Identity Attitudes Scale and Rokearch Values Inventory were applied to the participants within the scope of the research. The results of the study show that the social dominance orientations differ significantly between the gender identities. In addition, social dominance orientation differs significantly according to occupation field. There were positive or negative correlations between social dominance orientation and some of the purposive and instrumental values. In addition, social dominance orientation predicts gender identity, education, and income status assessment.

Comparative study of different programs for sound insulation calculations

Engineering programs for calculating sound insulation in wooden buildings are a shortage, especially when it comes to wooden structures. There are some possibilities today to calculate field values using commercial programs following ISO 12354. However, detailed calculations for each construction part are sometimes crucial to optimize correctly, specifically for CLT or wood beam structures since they are far more complex than traditional concrete structures. Now, some programs are available on the market to calculate sound insulation for CLT structures. StoraEnso offers "Calculatis" online for free, and Marshall Day Acoustics provides "Insul 10". In short, the company Sonusoft will release a software called "Acoulatis". These three programs have slightly different approaches, and their capability to calculate various wall and floor structures differs. Nevertheless, the different programs are all limited to walls or floors construction parts, e.g. the outcome is Rw and Ln,w including spectrum adaptation terms, e.g. junctions are not included. In this paper, a comparison is made using the three different programs, including comparisons to measured values when available.

Empirical validation of the use of projective techniques in psychological testing using Galois fields

It is shown that the problem of the adequacy of psychological testing methods, which are varieties of “projective techniques”, is far from being universally recognized. To solve this problem, we used an empirical method based on collecting of statistics of respondents’ answers, as well as a method of analyzing this statistics by means of representing permutations through functions taking values in Galois fields. Based on experimental data, it is shown that the distribution of respondents’ answers to a test in which they are asked to rank pictures in accordance with their own preferences is not homogeneous. Experimental data show that there are answer options that are statistically most common. An interpretation of testing is proposed in which passing the test is considered as “connecting” an external additional layer to the neural network formed by the respondent’s brain. In accordance with this interpretation, the most frequently occurring answer options can be considered as the basis for the formation of classification characteristics. It is shown that during using tests of this type it is advisable to take into account the code distances between the answer of a particular respondent and the codes corresponding to the most frequently occurring sequences. The possibilities of generating psychological tests directly based on experimental data and images generated by neural networks are discussed.

A two-step self consistent algorithm for extracting magnetic anisotropy constants from angle-dependent ferromagnetic resonance measurements

To infer anisotropy parameters of magnetic materials from experimental measurements of ferromagnetic resonance (FMR) (with data comprising resonant frequencies and corresponding resonant magnetic fields), a fitting procedure to the theoretical model is essential. The governing equation for this fitting process is the Smit–Beljers equation (SB equation), which links FMR frequencies to resonant magnetic field values and anisotropy parameters nonlinearly, and through the equilibrium magnetization angle values, which also depend on the same anisotropy parameters and magnetic field values. Obtaining an analytical expression for this equation is rarely possible. In this paper, we address the challenges posed by the Smit–Beljers equation and propose a two-step self-consistent algorithm to extract the relevant parameters efficiently.

Investigating instabilities in magnetized low-pressure capacitively coupled RF plasma using particle-in-cell (PIC) simulations

The effect of a uniform magnetic field on particle transport in low-pressure radio frequency (RF) capacitively coupled plasma (CCP) has been studied using a particle-in-cell model. Three distinct regimes of plasma behavior can be identified as a function of the magnetic field. In the first regime at low magnetic fields, asymmetric plasma profiles are observed within the CCP chamber due to the effect of E→×B→ drift. As the magnetic field increases, instabilities develop and form self-organized spoke-shaped structures that are distinctly seen within the bulk plasma closer to the sheath. In this second regime, the spoke-shaped coherent structures rotate inside the plasma chamber in the −E→×B→ direction, where E→ and B→ are the DC electric and magnetic field vectors, respectively, and the DC electric field exists in the sheath and pre-sheath regions. The spoke rotation frequency is in the megahertz range. As the magnetic field strength increases further, the rotating coherent spokes continue to exist near the sheath. The coherent structures are, however, accompanied by new small-scale incoherent structures originating and moving within the bulk plasma region away from the sheath. This is the third regime of plasma behavior. The threshold values of the magnetic field between these regimes were found not to vary with changing plasma reactor geometry (e.g., area ratio between ground and powered electrodes) or the use of an external capacitor between the RF-powered electrode and the RF source. The threshold values of the magnetic field between these regimes shift toward higher values with increasing gas pressure. Analysis of the results indicates that the rotating structures are due to the lower hybrid instability driven by density gradients and electron-neutral collisions. This paper provides guidance on the upper limit of the magnetic field for instability-free operation in low-pressure CCP-based semiconductor deposition and etch systems that use the external magnetic field for plasma uniformity control.

Design of an Objective Magnetic Lens and Study of its Magnetic and Optical Properties in the Scanning Electron Microscope

The study's objective is to investigate the optical properties of the objective magnetic lens, which is considered as the most crucial part of the electron microscope. Three models of objective lenses (Snorkel, Pinhole, Gemini), equal in geometric dimensions were taken, and their optical properties, as well as their magnetic properties. It was found that the lens (P) achieved the best results, which were studied at a continuous excitation (NI=2000 A-t) and different acceleration voltages ranging from (8-16 kV), in addition to different values for the aperture angle (α). Then, we conducted an improvement on the selected lens by changing the width of the air gap between the poles (S) and studying the properties of the lens. We obtained better results for spherical (Cs=1.62 mm) and chromatic (Cc=1.84 mm) aberrations, focal length (fₒ=2.92 mm), as well as the highest value of the magnetic field (Bz=0.38 T) at an acceleration voltage (Vr=10000 V), excitation (NI=2000 A-t), and air gap width (S=5 mm), and the diameter of the electron probe (dp=11.25 nm) at an aperture angle (α=2 mrad).

Assessment of the Weimer Geomagnetic Perturbation Model for High‐Latitude Positioning and Navigation

AbstractThe Geomagnetism Group at the National Centers for Environmental Information (NCEI), in collaboration with the Cooperative Institute for Research in Environmental Sciences (CIRES), along with various government and industry partners, specializes in developing and providing access to Earth's internal magnetic field models. These models are crucial for applications such as compass navigation and wellbore positioning, offering reference values for the geomagnetic field (total field, dip or inclination, and declination) at any location across the Earth. This study assesses the Weimer geomagnetic perturbation model, proposed by Weimer in 2013, which is an empirical model of magnetic field variations at high latitudes driven by solar wind measurements, as a candidate for capturing geomagnetic field variations in high‐latitude areas. We compare the geomagnetic field variations predicted by the Weimer model against data from the INTERMAGNET and SuperMAG observatory networks. Our findings indicate that the Weimer model achieves a reduction in the standard deviations of high‐latitude magnetic field variations by approximately 20%–30% once quiet‐time baselines are removed from the data set. Furthermore, we compare the performance of the Weimer model against the Space Weather Modeling Framework's Geospace model during specific geomagnetic storms in 2017 and 2018, and we find that the Weimer model is more effective in predicting magnetic variations at high latitudes than the Geospace model during these storms. Additionally, comparisons to magnetometer data collected from high‐latitude directional‐drilling operations align with the trends observed in comparisons with INTERMAGNET and SuperMAG observatory data, confirming the Weimer model's reliability and effectiveness for such applications.

Non-similar analysis of heat generation and thermal radiation on Eyring-Powell Hybrid nanofluid flow across a stretching surface

This paper portrays a two-dimensional mathematical model developed for the analysis of Eyring-Powell hybrid nanofluid flow, incorporating variable temperature and velocity profiles. This study investigates the flow through a porous media with a mixture of hybrid nanoparticles (copper dioxide, magnetite) integrated into ethylene glycol ([Formula: see text]) across a stretching sheet. The model takes magnetic effects, heat generation, and thermal radiation into account. Additionally, nonsimilar partial differential equations (PDEs) are transformed into ordinary differential equations using the local nonsimilarity approach. These equations are then numerically solved using the built-in Matlab function bvp4c. To examine the effects of adjusting parameters on heat, mass transfer, and skin friction, the results are displayed graphically. With an increase in the given values of magnetic field [Formula: see text], the velocity profile [Formula: see text] is seen to decay. Moreover, it is observed that the hybrid nanofluid density and dynamic viscosity increase as the volume fraction rises. It is estimated that the thermal conductivity and viscosity of the [Formula: see text] hybrid nanofluid are expected to increase to 4.1% and 12.35%, respectively, and to 71.55% and 78.01%, respectively, for volume concentrations ranging from 0.02% to 0.05%. It is also concluded that the local skin-friction coefficient has the opposite trend while the local Nusselt number rises monotonically with both the slip velocity parameter and the surface convection parameter. This research has broad applications In the glass and polymer industries, metallic plate cooling, plastic sheet contractions, etc.

L’annonce en oncologie pédiatrique – retour d’expérience sur les formations par méthode de simulation dans le GOCE (Grand Ouest cancer de l’enfant)

The announcement of a cancer diagnosis is a crucial moment in the management of the disease, as it is the starting point for a relationship of trust between patient and caregiver. In 2005, this issue led to the creation of an announcement system as part of the 2003-2007 cancer plan, but its implementation in practice remains uncertain. Pediatric oncology has its own specificities, with a triangular relationship and the need for doctors to adapt to the child's age. These skills require special training, and training opportunities vary from one area to another. To this end, the Angers and Caen centers have developed simulation exercises for training in pediatric oncology announcement. These consist of a theoretical part, followed by an announcement interview with actors, then a debriefing. Evaluation questionnaires are completed by learners before and after the session, and have highlighted the usefulness of this training, particularly in helping them to feel better prepared to face this stressful moment. As simulation has proved its educational value in the healthcare field, GOCE has developed simulation-based training courses for interns/CCAs/assistants in the territory. These courses are much appreciated and are proving extremely useful in clinical practice. This has led the SFCE to extend these courses to all CCAs and young PHs in pediatric oncology in France.

Separate prediction of underwater noise from drain pipes base on Vibration-acoustic coupling method

Abstract Since drain pipes on ships radiate underwater noise when in use, the components and radiation characteristics of flow noise and flow-induced noise from drain pipes on ships are explored, and the relationship between peak spectral values and wet mode frequencies is analyzed. The numerical calculation models of the flow field and structure for drain pipes are created respectively to obtain pulsating pressures in the flow field and structural mode values. Then, the flow noise and flow-induced noise are separately measured in an acoustic model developed for drain pipes upon the mapping of wall fluid meshes, structural meshes and acoustic meshes. A vibration-acoustic coupling model with the radiated sound field nephogram is presented based on the wall pulsating pressure and structural mode values. The numerical calculation indicated a significantly louder flow noise from drain pipes than the negligible flow-induced noise. The resulting wet mode of drain pipes solved by the Boundary Element Method (BEM) reflects the similarity between the peak spectral value and the wet mode frequency of flow-induced noise, marking that the fluid pulsating pressure excites noise.

The Observational and Numerical Analysis of the Rayleigh–Taylor Instability beneath a Hedgerow Prominence

Using Swedish 1 m Solar Telescope Crisp Imaging Spectro-Polarimeter 6563 Å (Hα) observations and Mancha3D simulations, we analyze the formation and evolution of falling knots beneath a hedgerow prominence. By comparing the observed knot widths and kinematics to those of a parametric survey of simulations, we estimate the range of magnetic field values and characteristic wavelengths to test if the magnetic Rayleigh–Taylor instability (MRTI) can provide a physically meaningful explanation. We recover observational parameters using a novel semiautomated method and find knot velocities with a mean of −9.68 km s−1 and a mean width of 614 km. Our simulations survey a range of critical wavelengths, λ c , of 100 to 500 km, and magnetic field strengths, B 0, of 1 to 20 G, finding the closest match to observations around λ c = 300 km, and B 0 = 2 to 6 G. As both the observational and simulated values match expected values, we conclude that the MRTI can provide a physically meaningful explanation of this observation. Additionally, we also predict that the Daniel K. Inouye Solar Telescope will be able to observationally recover secondary instabilities on the leading edge of the falling mass through applying a point-spread function to an example from the simulated results.

Reconstructing inflationary potential from NANOGrav 15-year Data: A robust study using Non-Bunch Davies initial condition

We discuss the theoretical framework behind reconstruction of a generic class of inflationary potentials for canonical single-field slow-roll inflation in a model-independent fashion. The Non-Bunch Davies (NBD) initial condition is an essential choice to determine the structure of potential and to accommodate the blue-tilted tensor power spectrum feature recently observed in NANOGrav. Using the reconstruction technique we found the favoured parameter space which supports blue tilted tensor power spectrum. The validity of the EFT prescription in inflation is also maintained through the use of a new field excursion formula while keeping the necessary and sufficient conditions on the sub-Planckian field values in check. We find that the reconstructed potential display inflection point behaviour, which has deeper connection with high energy physics.

Neutral donors confined in semiconductor coupled quantum dot-rings: Position-dependent properties and optical transparency phenomenon

Electronic properties of a neutral donor confined in a GaAs coupled quantum dot-ring covered by a Al0.3Ga0.7As matrix were calculated using the finite element method under the effective mass and the envelope function approximations. The proposed model is set up to fit a realistic coupled quantum dot-ring geometry revealed by atomic force microscopy images. The results show that the energy levels and the transition energies in the presence of an electric field strongly depend on the donor center’s angular position. Furthermore, the total optical absorption coefficient is calculated within the two-level approximation and the matrix density formalism. The absorption spectrum shows that the system can be tuned between 5 and 30meV. Also, an optical transparency effect for different configurations characterized by specific donor center’s angular positions and electric field values is seen. Finally, a novel redshift is observed when the sample temperature increases.

Improving the steering performance of microrobots by using a magnetically actuated technique

Mobile microrobots show the significance of potential medical procedures and challenge areas within the human body. An applied electromagnetic field is used as a precise magnetic actuation system for controllable steering mobility, and positioning is used. In this work, an adaptable microrobot is developed with an effective technique to enhance steering. An electromagnetic system is employed to produce an external magnetic field that guides a microrobot to improve its steerability. In particular, a driving system of eight coils creates a magnetic field that actuates the microrobot and enables upward and downward motion. Accordingly, three types of microrobot designs are proposed. Consequently, an efficient variation of steering in terms of deformation angle is achieved. The corresponding performance is determined mathematically in terms of the main system parameters, such as external magnetic field and microrobot geometry. In addition, finite element model is used for comparison and validation. Simulation results show that for a relatively high value of magnet field, namely, 15 mT and 90°, the deformation angles were 36.98° for the first design, 39.11° for the second design, and 34.48° for the third design in upward deformation. By contrast, the downward deformation ranges were –40.42°, –39.46°, and –37.04° for the first, second, and third designs, respectively, at –90° The error between the upward and downward steering of the second design had the lowest value of 0.35° The second design of the microrobots has the least error between the upward and downward deformation ratio at 0.89 %. In comparison, the first design has a 9.3 % error, and the third design has a 7.42 % error, with a relatively high value of magnetic field density (15 mT). Simulations have shown that the proposed second design is suitable for navigating narrow artery branches with the least error ratio and more precise control. This work verifies that the model could accurately control the steering of microrobots.