Hasil untuk "Materials of engineering and construction. Mechanics of materials"

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DOAJ Open Access 2026
Intelligent nanoparticles based on Fenton reaction for chemo/chemodynamic therapy against cervical cancer

Sihong Guo, Xinlei Yang, Wenxia Ai et al.

Cervical cancer is a malignant tumor that poses a significant threat to women’s health. Traditional chemotherapy (CT) is hindered by issues such as poor water solubility and inadequate targeting. Consequently, this study synthesized three amphiphilic molecules (PEG-SS-CPT, Fc-PEG-Fc, and cRGD-PEG-TK-DSPE) which were self-assembled to create intelligent nanoparticles, referred to as cRCF, for the purposes of synergistic CT and chemodynamic therapy (CDT). The cRCF nanoparticles can actively target tumor cells. Ferrocenecarboxylic acid (Fc) generates hydroxyl radicals via the Fenton reaction, thereby triggering ferroptosis. Elevated levels of glutathione (GSH) can cleave the disulfide bond, releasing the chemotherapeutic agent camptothecin (CPT), which induces apoptosis; additionally, the depletion of GSH further enhances the CDT effect. Both in vitro and in vivo experiments demonstrate that cRCF exhibits a significant anti-tumor effect, achieving an inhibition rate of 85.0 ± 6.9%, while also displaying favorable biocompatibility. This research provides a novel strategy for the treatment of cervical cancer that emphasizes high efficiency and low toxicity.

Materials of engineering and construction. Mechanics of materials
DOAJ Open Access 2026
Unified fracture criterion for brittle 2D materials

Shenda Jiang, Israel Greenfeld, Lin Yang et al.

Abstract Two-dimensional materials (2DMs), possessing atomic-scale thickness, are prone to brittle fracture under loading conditions, which can lead to catastrophic failure. As their structural dimensions approach the nanoscale, conventional linear elastic fracture mechanics (LEFM) based on continuum assumptions is deficient in capturing the underlying failure mechanisms and accurately predicting potential crack instability. This limitation emphasizes the critical need for a new theoretical approach suited to the fracture behavior of 2DM systems. We propose a unified fracture mechanics (UFM) criterion that systematically incorporates two key physical mechanisms governing brittle fracture in 2DMs at the nanoscale, namely nonlinear elasticity and atomic-scale discreteness. By introducing two corrective parameters, for nonlinearity and quantization, the UFM model successfully resolves the limitations of LEFM in predicting failure. This is particularly important in the short crack regime, as small defects are frequent in 2DMs. The theoretical predictions show excellent agreement with molecular dynamics simulations of five different types of 2DMs and accurately capture the fracture strength of both cracked and defect-free structures. In addition, we present an empirical method that allows the fracture behavior of 2DMs to be estimated directly from their intrinsic structural and elastic properties. The unified theoretical framework is applicable not only to the materials simulated in this study but may also be applied to a broader class of atomically thin brittle systems.

Materials of engineering and construction. Mechanics of materials, Computer software
DOAJ Open Access 2026
Research Progress on Interference and Protection of Grounding Electrodes of HVDC Transmission on Buried Pipeline

GAO Jie, TIAN Haizhou, LI Shaofei, LIU Tianhui, GUO Xiaodong, AN Bing, LU Tao

With the increasing number of high voltage direct current(HVDC) transmission projects in China,the issue of interference from HVDC system grounding electrodes on buried metal pipelines has become increasingly prominent.In order to conduct accurate research and analysis as well as protection assessment for the interference issue,this paper surveyed the research methodologies and influencing factors associated with HVDC system interference in recent years.The interference and corrosion patterns on pipelines were analyzed from four aspects: on-site field tests,laboratory simulation experiments,numerical simulation techniques and influencing factors.Meanwhile,the stray current protection technologies currently commonly used in HVDC systems in China were summarized,and their advantages,disadvantages and applicable scopes were elaborated.Finally,the research directions of stray current interference and protection were prospected.

Materials of engineering and construction. Mechanics of materials, Technology
DOAJ Open Access 2025
Analysis of Heat Loads and Lining Wear of Blast-Furnace Crucible of Various Designs

B. Kornilov, O. Chaika, O. Merkulov et al.

The article presents the results of analysis of thermal operation and hearth lining melting of blast furnaces of various designs on the basis of information from the system of monitoring of thermal operation and hearth lining melting – mathematical model “Hearth” developed in Iron and Steel Institute NAS of Ukraine (ISI NASU). Realization of continuous monitoring of the hearth melting in blast furnaces made it possible to estimate the effect of using “ceramic cup” in terms of the value of heat losses of the hearth and coke consumption for their compensation. It is established that the value of specific heat loss per unit volume of blast furnace in blast furnaces with a “ceramic cup” ~ 0,4-0,7 kW/m3, in blast furnaces without it ~0,9-1,1 kW/m3. Ceramic cup gives savings of about 1 kg/t-HM of coke.

Mining engineering. Metallurgy, Materials of engineering and construction. Mechanics of materials
arXiv Open Access 2025
Hierarchical Deep Research with Local-Web RAG: Toward Automated System-Level Materials Discovery

Rui Ding, Rodrigo Pires Ferreira, Yuxin Chen et al.

We present a long-horizon, hierarchical deep research (DR) agent designed for complex materials and device discovery problems that exceed the scope of existing Machine Learning (ML) surrogates and closed-source commercial agents. Our framework instantiates a locally deployable DR instance that integrates local retrieval-augmented generation with large language model reasoners, enhanced by a Deep Tree of Research (DToR) mechanism that adaptively expands and prunes research branches to maximize coverage, depth, and coherence. We systematically evaluate across 27 nanomaterials/device topics using a large language model (LLM)-as-judge rubric with five web-enabled state-of-the-art models as jurors. In addition, we conduct dry-lab validations on five representative tasks, where human experts use domain simulations (e.g., density functional theory, DFT) to verify whether DR-agent proposals are actionable. Results show that our DR agent produces reports with quality comparable to--and often exceeding--those of commercial systems (ChatGPT-5-thinking/o3/o4-mini-high Deep Research) at a substantially lower cost, while enabling on-prem integration with local data and tools.

en cs.LG, cond-mat.mes-hall
arXiv Open Access 2025
Large non-saturating Nernst thermopower and magnetoresistance in compensated semimetal ScSb

Antu Laha, Sarah Paone, Niraj Aryal et al.

Today, high-performance thermoelectric and thermomagnetic materials operating in the low-temperature regime, particularly below the boiling point of liquid nitrogen remain scarce. Most thermomagnetic materials reported to date exhibit a strong Nernst signal along specific crystallographic directions in their single-crystal form. However, their performance typically degrades significantly in the polycrystalline form. Here, we report an improved Nernst thermopower of $\sim$ 128 $μ$V/K at 30 K and 14 T in polycrystalline compensated semimetal ScSb, in comparison to that was observed in single crystal ScSb previously. The magnetic field dependence of Nernst thermopower shows a linear and non-saturating behavior up to 14 T. The maximum Nernst power factor reaches to $\sim 240 \times 10^{-4}$ W m$^{-1}$ K$^{-2}$ and Nernst figure of merit reaches to $\sim 11 \times 10^{-4}$ K$^{-1}$. Polycrystalline ScSb also shows a large non-saturating magnetoresistance of $\sim 940 \%$ at 2 K and 14 T. These enhanced properties originate from better electron-hole compensation, as revealed by Hall resistivity measurements. The cubic symmetry and absence of anisotropy in ScSb allow its polycrystalline form to achieve similar enhanced thermomagnetic and electromagnetic performance comparable to that of the single crystal.

en cond-mat.mtrl-sci
DOAJ Open Access 2024
Optimisation of mechanical behaviour of Calotropis gigantea and Prosopis juliflora natural fibre-based hybrid composites by using Taguchi-Grey relational analysis

Velmurugan Ganesan, Vigneshwaran Shanmugam, Vasudevan Alagumalai et al.

The properties of organic fibre-based hybrid materials are influenced by a variety of factors and even minor changes in these variables can outcome in substantial discrepancies in strength. In this regard, the current study aims to optimise various influencing parameters such as weight percentage, alkaline treatment concentration, and fabrication parameters (compression moulding pressure, and temperature), with the goal of enhancing the overall strength of the composite. Calotropis gigantea-stem and Prosopis juliflora-bark fibres were used in varying weight percentages to create epoxy-based hybrid composites. After fabrication the mechanical characterisation like tensile, flexural, and impact properties of the composites were tested. Taguchi experimental design was applied, and the results were analysed using a hybrid Taguchi-grey relational investigation method. It was observed that a combination of 20 wt.% Calotropis gigantea/20 wt.% Prosopis juliflora/6 % NaOH pretreatment/100 °C temperature with 14 MPa pressure and had the most desirable mechanical properties in the fabricated composites. Calotropis gigantea ranks first in enhancing the composite strength, followed by Prosopis Juliflora, NaOH pretreatment%, compression moulding temperature and pressure. This work highlights the significant role of Calotropis gigantea and Prosopis Juliflora fibres in enhancing composite strength and provides valuable insights for future research in the field of hybrid composite development.

Materials of engineering and construction. Mechanics of materials
DOAJ Open Access 2024
Femtosecond laser-induced nanoparticle implantation into flexible substrate for sensitive and reusable microfluidics SERS detection

Yongxiang Hu, Yu Zhou, Guohu Luo et al.

Surface-enhanced Raman spectroscopy (SERS) microfluidic system, which enables rapid detection of chemical and biological analytes, offers an effective platform to monitor various food contaminants and disease diagnoses. The efficacy of SERS microfluidic systems is greatly dependent on the sensitivity and reusability of SERS detection substrates to ensure repeated use for prolonged periods. This study proposed a novel process of femtosecond laser nanoparticle array (NPA) implantation to achieve homogeneous forward transfer of gold NPA on a flexible polymer film and accurately integrated it within microfluidic chips for SERS detection. The implanted Au-NPA strips show a remarkable electromagnetic field enhancement with the factor of 9 × 10 ^8 during SERS detection of malachite green (MG) solution, achieving a detection limit lower than 10 ppt, far better than most laser-prepared SERS substrates. Furthermore, Au-NPA strips show excellent reusability after several physical and chemical cleaning, because of the robust embedment of laser-implanted NPA in flexible substrates. To demonstrate the performance of Au-NPA, a SERS microfluidic system is built to monitor the online oxidation reaction between MG/NaClO reactants, which helps infer the reaction path. The proposed method of nanoparticle implantation is more effective than the direct laser structuring technique. It provides better performance for SERS detection, robustness of detection, and substrate flexibility and has a wider range of applications for microfluidic systems without any negative impact.

Materials of engineering and construction. Mechanics of materials, Industrial engineering. Management engineering
DOAJ Open Access 2024
Mechanical and shape-memory properties of TPMS with hybrid configurations and materials

Tianzhen Liu, Wei Zhao, Yongtao Yao et al.

Triply periodic minimal surface (TPMS) structures with excellent properties of stable energy absorption, light weight, and high specific strength could potentially spark immense interest for novel and programmable functions by combining smart materials, e.g. shape memory polymers (SMPs). This work proposes TPMS lattices with hybrid configurations and materials that are composed of viscoelastic and shape-memory materials with the aim to bring temperature-dependent mechanical properties and additional dissipation mechanisms. Different configurations and diverse materials of polylactic acid (PLA), fiber-reinforced PLA, and polydimethylsiloxane (PDMS) are induced, generating five types of TPMS lattices, including (Schoen’s I-WP) IWP uniform lattice, IWP lattice with density gradient, hybrid configurations, hybrid materials, and filled PDMS, which are fabricated by 3D printing. The fracture morphologies and the distribution of carbon fibers are demonstrated via scanning electron microscopy with a focus on the influence of carbon fiber on shape-memory and mechanical properties. Shape recovery tests are conducted, which proves good shape memory properties and reusable capability of TPMS lattice. The combined methods of experiments and numerical simulation are adopted to evaluate mechanical properties, which presents multi-stage energy absorption ability and tunable vibration isolation performances associated with temperature and hybridization designs. This work can promote extensive research and provide substantial opportunities for TPMS lattices in the development of functional applications.

Materials of engineering and construction. Mechanics of materials
DOAJ Open Access 2023
Wear Behavior of Brass Based Composite Reinforced with SiC and Produced by Stir Casting Process

E. Mohan, G. Anbuchezhiyan, R. Pugazhenthi et al.

Abstract The current investigation presents the wear-worn surface analysis of a silicon carbide-reinforced brass-based composite synthesized by stir casting. Wear behavior of the brass composite pin was analyzed by disc tribometer. Wear characterization studies and confirmation of elemental composition are investigated through scanning electron microscopy (SEM) and energy dispersive spectroscopy (EDS) respectively. The worn surface of the synthesized brass composite was analyzed using atomic force microscopy (AFM). The aim of the investigation is to examine the surface morphology of the worn specimen. Based on the input constraints, the wear rate ranges from 0.0135 to 0.0893 mm3/min. The applied load is the predominant factor in the wear rate (83.75%). Sliding velocity has a minor effect on wear rate (1.06%). The improved surface roughness of 15.27 nm was produced on the worn surface. The novelty of the research work is to study the various surface parameters of the worn surface, such as roughness average, root mean square roughness, maximum height of the roughness, skewness, and kurtosis. These parameters were analyzed at different wear-worn surfaces of the synthesized brass composite. The wear-worn surface was deeply investigated and incorporated with SEM and AFM analysis.

Materials of engineering and construction. Mechanics of materials
DOAJ Open Access 2023
Improving hard metal implant and soft tissue integration by modulating the “inflammatory-fibrous complex” response

Peina Huang, Jieyun Xu, Lv Xie et al.

Soft tissue integration is one major difficulty in the wide applications of metal materials in soft tissue-related areas. The inevitable inflammatory response and subsequent fibrous reaction toward the metal implant is one key response for metal implant-soft tissue integration. It is of great importance to modulate this inflammatory-fibrous response, which is mainly mediated by the multidirectional interaction between fibroblasts and macrophages. In this study, macrophages are induced to generate M1 and M2 macrophage immune microenvironments. Their cytokine profiles have been proven to have potentially multi-regulatory effects on fibroblasts. The multi-reparative effects of soft tissue cells (human gingival fibroblasts) cultured on metal material (titanium alloy disks) in M1 and M2 immune microenvironments are then dissected. Fibroblasts in the M1 immune microenvironment tend to aggravate the inflammatory response in a pro-inflammatory positive feedback loop, while M2 immune microenvironment enhances multiple functions of fibroblasts in soft tissue integration, including soft tissue regeneration, cell adhesion on materials, and contraction to immobilize soft tissue. Enlighted by the close interaction between macrophages and fibroblasts, we propose the concept of an “inflammatory-fibrous complex” to disclose possible methods of precisely and effectively modulating inflammatory and fibrous responses, thus advancing the development of metal soft tissue materials.

Materials of engineering and construction. Mechanics of materials, Biology (General)
arXiv Open Access 2023
Theoretical approach to ferroelectricity in hafnia and related materials

Hugo Aramberri, Jorge Íñiguez

Hafnia ferroelectrics combine technological promise and unprecedented behaviors. Their peculiarity stems from the many active extrinsic mechanisms that contribute to their properties and from a continuously growing number of novel intrinsic features. Partly because of their unconventional nature, basic questions about these materials remain open and one may wonder about the pertinence of some frequent theoretical assumptions. Aided by first-principles simulations, here we show that, by adopting an original high-symmetry reference phase as the starting point of the analysis, we can develop a mathematically simple and physically transparent treatment of the ferroelectric state of hafnia. The proposed approach describes hafnia as a uniaxial ferroic, as suggested by recent studies of (woken-up) samples with well developed polarization. Also, it is compatible with the occurrence of polar soft modes and proper ferroelectric order. Further, our theory provides a straightforward and unified description of all low-energy polymorphs, shedding light into old questions (e.g., the prevalence of the monoclinic ground state), pointing at exciting possibilities (e.g., an antiferroelastic behavior) and facilitating the future development of perturbative theories (from Landau to second-principles potentials). Our work thus yields a deeper understanding of hafnia ferroelectrics, improving our ability to optimize their properties and induce new ones.

en cond-mat.mtrl-sci
DOAJ Open Access 2022
Synthesis of ultra‐high molecular weight core cross‐linked star (CCS) polymer using high molecular weight spherical nanoparticles and arm‐first method

Guangyao Liu, Yongqi Yang, Chao Zheng et al.

Abstract P (N,N‐Dimethylacrylamide) ‐b‐P (2‐methoxyethyl acrylate) (PDMA‐b‐PMEA) and Poly (poly (ethylene glycol) methyl ether methacrylate) ‐b‐P (2‐methoxyethyl acrylate) (PPEGMA‐b‐PMEA) di‐block copolymer nanoparticles are prepared by RAFT dispersion polymerization in water at 35°C. By changing the degree of polymerization (DP) of PMEA and the solid content of the reaction solution, only spherical nanoparticles are obtained. Using PDMA and PPEGMA as macromolecular chain transfer agents (Macro‐CTA), the actual DP of PMEA block can be up to 11,520 and 17,000, respectively, the size of the obtained spherical nanoparticles can be close to 600 nm, and the molecular weight of the block copolymer can reach 106. Such large spheres may serve as model sterically stabilized particles for analytical centrifugation studies. In the mixed solvent of ethanol and water (1:1, v/v), we synthesize ultra‐high molecular weight CCS polymer by the arm‐first method. Star polymer with such high molecular weight and small particle size can be used for emulsification.

Materials of engineering and construction. Mechanics of materials
arXiv Open Access 2022
Scattering mechanisms in state-of-the-art GaAs/AlGaAs quantum wells

Yi Huang, B. I. Shklovskii, M. A. Zudov

Motivated by recent breakthrough in molecular beam epitaxy of GaAs/AlGaAs quantum wells [Y. J. Chung \textit{et al.}, Nature Materials \textbf{20}, 632 (2021)], we examine contributions to mobility and quantum mobility from various scattering mechanisms and their dependencies on the electron density. We find that at lower electron densities, $n_e \lesssim 1 \times 10^{11}$ cm$^{-2}$, both transport and quantum mobility are limited by unintentional background impurities and follow a power law dependence, $\propto n_e^α$, with $α\approx 0.85$. Our predictions for quantum mobility are in reasonable agreement with an estimate obtained from the resistivity at filling factor $ν= 1/2$ in a sample of Y. J. Chung \textit{et al.} with $n_e = 1 \times 10^{11}$ cm$^{-2}$. Consideration of other scattering mechanisms indicates that interface roughness (remote donors) is a likely limiting factor of transport (quantum) mobility at higher electron densities. Future measurements of quantum mobility should yield information on the distribution of background impurities in GaAs and AlGaAs.

en cond-mat.mes-hall, cond-mat.mtrl-sci
arXiv Open Access 2022
Two-dimensional anisotropic Dirac materials PtN4C2 and Pt2N8C6 with quantum spin and valley Hall effects

Jingping Dong, Chuhan Wang, Xinlei Zhao et al.

We propose two novel two-dimensional topological Dirac materials, planar PtN4C2 and Pt2N8C6, which exhibit graphene-like electronic structures with linearly dispersive Dirac-cone states exactly at the Fermi level. Moreover, the Dirac cone is anisotropic, resulting in anisotropic Fermi velocities and making it possible to realize orientation-dependent quantum devices. Using the first-principles electronic structure calculations, we have systemically studied the structural, electronic, and topological properties. We find that spin-orbit coupling opens a sizable topological band gap so that the materials can be classified as quantum spin Hall insulators as well as quantum valley Hall insulators. Helical edge states that reside in the insulating band gap connecting the bulk conduction and valence bands are observed. Our work not only expands the Dirac cone material family, but also provides a new avenue to searching for more two-dimensional topological quantum spin and valley Hall insulators.

en cond-mat.mtrl-sci, cond-mat.mes-hall
arXiv Open Access 2022
Magnetically tunable Dirac and Weyl fermions in the Zintl materials family

Anan Bari Sarkar, Sougata Mardanya, Shin-Ming Huang et al.

Recent classification efforts encompassing crystalline symmetries have revealed rich possibilities for solid-state systems to support a tapestry of exotic topological states. However, finding materials that realize such states remains a daunting challenge. Here we show how the interplay of topology, symmetry, and magnetism combined with doping and external electric and magnetic field controls can be used to drive the previously unreported SrIn$_2$As$_2$ materials family into a variety of topological phases. Our first-principles calculations and symmetry analysis reveal that SrIn$_2$As$_2$ is a dual topological insulator with $Z_2=(1;000)$ and mirror Chern number $C_M= -1$. Its isostructural and isovalent antiferromagnetic cousin EuIn$_2$As$_2$ is found to be an axion insulator with $Z_4= 2$. The broken time-reversal symmetry via Eu doping in Sr$_{1-x}$Eu$_x$In$_2$As$_2$ results in a higher-order or topological crystalline insulator state depending on the orientation of the magnetic easy axis. We also find that antiferromagnetic EuIn$_2$P$_2$ is a trivial insulator with $Z_4= 0$, and that it undergoes a magnetic field-driven transition to an ideal Weyl fermion or nodal fermion state with $Z_4= 1$ with applied magnetic field. Our study identifies Sr$_{1-x}$Eu$_x$In$_2$(As, P)$_2$ as a new tunable materials platform for investigating the physics and applications of Weyl and nodal fermions in the scaffolding of crystalline and axion insulator states.

en cond-mat.mes-hall, cond-mat.mtrl-sci
arXiv Open Access 2022
Designing spin and orbital sources of Berry curvature at oxide interfaces

Edouard Lesne, Yildiz G. Saǧlam, Raffaele Battilomo et al.

Quantum materials can display physical phenomena rooted in the geometry of electronic wavefunctions. The corresponding geometric tensor is characterized by an emergent field known as Berry curvature (BC). Large BCs typically arise when electronic states with different spin, orbital or sublattice quantum numbers hybridize at finite crystal momentum. In all materials known to date, the BC is triggered by the hybridization of a single type of quantum number. Here, we report the discovery of the first material system having both spin and orbital-sourced BC: LaAlO$_3$/SrTiO$_3$ interfaces grown along the [111] direction. We detect independently these two sources and directly probe the BC associated to the spin quantum number through measurements of an anomalous planar Hall effect. The observation of a nonlinear Hall effect with time-reversal symmetry signals large orbital-mediated BC dipoles. The coexistence of different forms of BC enables the combination of spintronic and optoelectronic functionalities in a single material.

en cond-mat.mes-hall, cond-mat.mtrl-sci
DOAJ Open Access 2021
Large bias-induced piezoelectric response in the ferroelectric polymer P(VDF-TrFE) for MEMS resonators

Jonas Hafner, Marco Teuschel, Davide Disnan et al.

Piezoelectricity in ferroelectrics arises from electrostriction biased by their spontaneous polarisation, which can be enhanced through a bias-induced polarisation. Doing so, the piezoelectric response can be tuned and significantly enhanced. In this study, the ferroelectric polymer P(VDF-TrFE) was used to electro-mechanically excite a silicon microcantilever. Using this device, we demonstrate that a bias-induced polarisation improves the piezoelectric response of P(VDF-TrFE). To distinguish between the linear piezoelectric and quadratic electrostrictive effect, lock-in measurements were performed in order to separate the characteristic frequency response of both electro-mechanical phenomena. This work shows the potential for MEMS devices having controllable actuating and sensing properties.

Materials of engineering and construction. Mechanics of materials

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