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Defects and anomalies in powder bed fusion metal additive manufacturing 粉末床熔融金属增材制造中的缺陷与异常
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-04-01 DOI: 10.1016/j.cossms.2021.100974
Amir Mostafaei , Cang Zhao , Yining He , Seyed Reza Ghiaasiaan , Bo Shi , Shuai Shao , Nima Shamsaei , Ziheng Wu , Nadia Kouraytem , Tao Sun , Joseph Pauza , Jerard V. Gordon , Bryan Webler , Niranjan D. Parab , Mohammadreza Asherloo , Qilin Guo , Lianyi Chen , Anthony D. Rollett

Metal additive manufacturing is a disruptive technology that is revolutionizing the manufacturing industry. Despite its unrivaled capability for directly fabricating metal parts with complex geometries, the wide realization of the technology is currently limited by microstructural defects and anomalies, which could significantly degrade the structural integrity and service performance of the product. Accurate detection, characterization, and prediction of these defects and anomalies have an important and immediate impact in manufacturing fully-dense and defect-free builds. This review seeks to elucidate common defects/anomalies and their formation mechanisms in powder bed fusion additive manufacturing processes. They could arise from raw materials, processing conditions, and post-processing. While defects/anomalies in laser welding have been studied extensively, their formation and evolution remain unclear. Additionally, the existence of powder in powder bed fusion techniques may generate new types of defects, e.g., porosity transferring from powder to builds. Practical strategies to mitigate defects are also addressed through fundamental understanding of their formation. Such explorations enable the validation and calibration of models and ease the process qualification without costly trial-and-error experimentation.

金属增材制造是一项颠覆性技术,正在彻底改变制造业。尽管该技术在直接制造具有复杂几何形状的金属零件方面具有无与伦比的能力,但目前该技术的广泛实现受到微观结构缺陷和异常的限制,这些缺陷和异常可能会严重降低产品的结构完整性和使用性能。这些缺陷和异常的准确检测、表征和预测对制造全密度和无缺陷的构建具有重要和直接的影响。本文旨在阐明粉末床熔融增材制造过程中常见的缺陷/异常及其形成机制。它们可能来自原材料、加工条件和后处理。虽然对激光焊接中的缺陷/异常进行了广泛的研究,但它们的形成和演变仍不清楚。此外,粉末床熔合技术中粉末的存在可能会产生新的缺陷类型,例如,从粉末到构建物的孔隙转移。通过对缺陷形成的基本理解,还讨论了减轻缺陷的实用策略。这样的探索使模型的验证和校准成为可能,并且在没有昂贵的试错实验的情况下简化了过程鉴定。
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引用次数: 108
Machine learning in nuclear materials research 核材料研究中的机器学习
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-04-01 DOI: 10.1016/j.cossms.2021.100975
Dane Morgan , Ghanshyam Pilania , Adrien Couet , Blas P. Uberuaga , Cheng Sun , Ju Li

Nuclear materials are often demanded to function for extended time in extreme environments, including high radiation fluxes with associated transmutations, high temperature and temperature gradients, mechanical stresses, and corrosive coolants. They also have a wide range of microstructural and chemical makeups, resulting in multifaceted and often out-of-equilibrium interactions. Machine learning (ML) is increasingly being used to tackle these complex time-dependent interactions and aid researchers in developing models and making predictions, sometimes with better accuracy than traditional modeling that focuses on one or two parameters at a time. Conventional practices of acquiring new experimental data in nuclear materials research are often slow and expensive, limiting the opportunity for data-centric ML, but new methods are changing that paradigm. Here we review high-throughput computational and experimental data approaches, especially robotic experimentation and active learning that is based on Gaussian process and Bayesian optimization. We show ML examples in structural materials (e.g., reactor pressure vessel (RPV) alloys and radiation detecting scintillating materials) and highlight new techniques of high-throughput sample preparation and characterizations, and automated radiation/environmental exposures and real-time online diagnostics. This review suggests that ML models of material constitutive relations in plasticity, damage, and even electronic and optical responses to radiation are likely to become powerful tools as they develop. Finally, we speculate on how the recent trends of using natural language processing (NLP) to aid the collection and analysis of literature data, interpretable artificial intelligence (AI), and the use of streamlined scripting, database, workflow management, and cloud computing platforms that will soon make the utilization of ML techniques as commonplace as the spreadsheet curve-fitting practices of today.

通常要求核材料在极端环境下长时间工作,包括伴随嬗变的高辐射通量、高温和温度梯度、机械应力和腐蚀性冷却剂。它们还具有广泛的微观结构和化学组成,导致多方面和经常不平衡的相互作用。机器学习(ML)越来越多地被用于解决这些复杂的时间依赖性相互作用,并帮助研究人员开发模型和做出预测,有时比一次只关注一两个参数的传统建模更准确。在核材料研究中获取新实验数据的传统做法通常是缓慢而昂贵的,限制了以数据为中心的机器学习的机会,但新方法正在改变这种模式。在这里,我们回顾了高通量的计算和实验数据方法,特别是基于高斯过程和贝叶斯优化的机器人实验和主动学习。我们展示了结构材料(例如,反应堆压力容器(RPV)合金和辐射检测闪烁材料)中的ML示例,并重点介绍了高通量样品制备和表征,自动化辐射/环境暴露和实时在线诊断的新技术。这篇综述表明,随着材料本构关系的发展,塑性、损伤甚至辐射的电子和光学响应的ML模型可能会成为强大的工具。最后,我们推测了最近使用自然语言处理(NLP)来帮助收集和分析文献数据、可解释的人工智能(AI)以及使用流线型脚本、数据库、工作流管理和云计算平台的趋势,这些趋势将很快使ML技术的利用像今天的电子表格曲线拟合实践一样普遍。
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引用次数: 29
Thermal conductivity of intercalation, conversion, and alloying lithium-ion battery electrode materials as function of their state of charge 插层、转换和合金化锂离子电池电极材料的导热系数随其电荷状态的变化
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-04-01 DOI: 10.1016/j.cossms.2021.100980
Jungwoo Shin , Sanghyeon Kim , Hoonkee Park , Ho Won Jang , David G. Cahill , Paul V. Braun

Upon insertion and extraction of lithium, materials important for electrochemical energy storage can undergo changes in thermal conductivity (Λ) and elastic modulus (M). These changes are attributed to evolution of the intrinsic thermal carrier lifetime and interatomic bonding strength associated with structural transitions of electrode materials with varying degrees of reversibility. Using in situ time-domain thermoreflectance (TDTR) and picosecond acoustics, we systemically study Λ and M of conversion, intercalation and alloying electrode materials during cycling. The intercalation V2O5 and TiO2 exhibit non-monotonic reversible Λ and M switching up to a factor of 1.8 (Λ) and 1.5 (M) as a function of lithium content. The conversion Fe2O3 and NiO undergo irreversible decays in Λ and M upon the first lithiation. The alloying Sb shows the largest and partially reversible order of the magnitude switching in Λ between the delithiated (18 W m−1 K−1) and lithiated states (<1 W m−1 K−1). The irreversible Λ is attributed to structural degradation and pulverization resulting from substantial volume changes during cycling. These findings provide new understandings of the thermal and mechanical property evolution of electrode materials during cycling of importance for battery design, and also point to pathways for forming materials with thermally switchable properties.

在插入和提取锂后,对电化学储能至关重要的材料会发生导热系数(Λ)和弹性模量(M)的变化。这些变化归因于与电极材料结构转变相关的具有不同可逆性程度的固有热载子寿命和原子间键强度的演变。利用原位时域热反射(TDTR)和皮秒声学技术,系统地研究了循环过程中转换、插层和合金电极材料的Λ和M。插层V2O5和TiO2表现出非单调可逆Λ和M随锂含量的变化分别为1.8 (Λ)和1.5 (M)。在第一次锂化过程中,Fe2O3和NiO在Λ和M中发生不可逆的衰变。合金Sb在Λ中显示出最大且部分可逆的衰减态(18 W m−1 K−1)和锂化态(<1 W m−1 K−1)之间的数量级转换。不可逆Λ是由于循环过程中大量体积变化导致的结构降解和粉碎。这些发现提供了对电池设计中重要的循环过程中电极材料的热学和力学性能演变的新理解,也指出了形成具有热可切换性能的材料的途径。
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引用次数: 8
Supported catalysts for heterogeneous electro-Fenton processes: Recent trends and future directions 非均相电fenton工艺的负载催化剂:最新趋势和未来方向
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-04-01 DOI: 10.1016/j.cossms.2022.100981
Ashitha Gopinath , Lakshmi Pisharody , Amishi Popat , P.V. Nidheesh

Extremely low pH requirement and additional sludge management for the homogeneous electro-Fenton (EF) process necessitated the development of heterogeneous electro-Fenton (HEF) reactions that utilize solid catalysts that can be recovered and reused. In the recent decades, supported catalysts have immensely attracted researchers owing to the outstanding physical, chemical, and electronic properties of the supports that benefit the EF process by enhancing the removal efficiency, reducing reaction time, and extending the operational pH range. This review enlightens the readers about various materials that have been used for supporting the catalysts, their importance, method of impregnation, and optimum conditions required to attain maximum pollutant removal. From the wide array of catalysts reviewed, porous supports with a high surface area such as activated carbon, biochar and fibres adsorbs the pollutants near their surface facilitating enhanced Fenton reactions and degradation of pollutants. Alginate-based catalysts can be prepared by a simple procedure and exhibit good degradation efficiency when used in batch and continuous EF reactors. Zeolite-based catalysts are structurally stable and display promising results for successive cycles. The flexible and conductive nature of fibre-based supports performs the dual role as a catalyst and cathode. The highly stable and conductive properties of graphene and carbon nanotubes promote electron transfer, much required for continuous EF reactions.

均相电- fenton (EF)工艺的极低pH值要求和额外的污泥管理,使得非均相电- fenton (HEF)反应的发展成为必要,这种反应利用可回收再利用的固体催化剂。近几十年来,负载型催化剂因其卓越的物理、化学和电子特性而受到了研究者的极大关注,这些特性通过提高去除效率、缩短反应时间和扩大操作pH范围而有利于EF过程。本文综述了用于催化剂载体的各种材料,它们的重要性,浸渍方法,以及达到最大污染物去除所需的最佳条件。从各种各样的催化剂来看,具有高表面积的多孔载体,如活性炭、生物炭和纤维,可以在其表面附近吸附污染物,促进芬顿反应和污染物的降解。海藻酸盐基催化剂制备方法简单,在间歇反应器和连续反应器中均表现出良好的降解效率。沸石基催化剂结构稳定,在连续循环中表现出良好的效果。纤维基支架的柔韧性和导电性发挥了催化剂和阴极的双重作用。石墨烯和碳纳米管的高稳定性和导电性促进了电子转移,这是连续EF反应所必需的。
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引用次数: 46
Overcoming the limitations of COVID-19 diagnostics with nanostructures, nucleic acid engineering, and additive manufacturing 利用纳米结构、核酸工程和增材制造克服新冠肺炎诊断的局限性
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-02-01 DOI: 10.1016/j.cossms.2021.100966
Nantao Li , Bin Zhao , Robert Stavins , Ana Sol Peinetti , Neha Chauhan , Rashid Bashir , Brian T. Cunningham , William P. King , Yi Lu , Xing Wang , Enrique Valera

The COVID-19 pandemic revealed fundamental limitations in the current model for infectious disease diagnosis and serology, based upon complex assay workflows, laboratory-based instrumentation, and expensive materials for managing samples and reagents. The lengthy time delays required to obtain test results, the high cost of gold-standard PCR tests, and poor sensitivity of rapid point-of-care tests contributed directly to society’s inability to efficiently identify COVID-19-positive individuals for quarantine, which in turn continues to impact return to normal activities throughout the economy. Over the past year, enormous resources have been invested to develop more effective rapid tests and laboratory tests with greater throughput, yet the vast majority of engineering and chemistry approaches are merely incremental improvements to existing methods for nucleic acid amplification, lateral flow test strips, and enzymatic amplification assays for protein-based biomarkers. Meanwhile, widespread commercial availability of new test kits continues to be hampered by the cost and time required to develop single-use disposable microfluidic plastic cartridges manufactured by injection molding. Through development of novel technologies for sensitive, selective, rapid, and robust viral detection and more efficient approaches for scalable manufacturing of microfluidic devices, we can be much better prepared for future management of infectious pathogen outbreaks. Here, we describe how photonic metamaterials, graphene nanomaterials, designer DNA nanostructures, and polymers amenable to scalable additive manufacturing are being applied towards overcoming the fundamental limitations of currently dominant COVID-19 diagnostic approaches. In this paper, we review how several distinct classes of nanomaterials and nanochemistry enable simple assay workflows, high sensitivity, inexpensive instrumentation, point-of-care sample-to-answer virus diagnosis, and rapidly scaled manufacturing.

COVID-19大流行揭示了当前传染病诊断和血清学模型的根本局限性,该模型基于复杂的分析工作流程、基于实验室的仪器以及用于管理样品和试剂的昂贵材料。获得检测结果所需的长时间延迟、金标准PCR检测的高成本以及快速即时检测的低灵敏度直接导致社会无法有效识别covid -19阳性个体进行隔离,这反过来继续影响整个经济恢复正常活动。在过去的一年里,我们投入了大量的资源来开发更有效的快速检测和更高通量的实验室检测,然而绝大多数的工程和化学方法仅仅是对现有的核酸扩增、侧流试纸和酶扩增检测蛋白质生物标志物的方法的渐进改进。同时,新测试套件的广泛商业可用性继续受到开发一次性微流体塑料盒所需的成本和时间的阻碍,这些盒是通过注射成型制造的。通过开发灵敏、选择性、快速和强大的病毒检测新技术,以及更有效的微流控设备可扩展制造方法,我们可以为未来传染性病原体爆发的管理做好更好的准备。在这里,我们描述了如何应用光子超材料、石墨烯纳米材料、设计DNA纳米结构和适用于可扩展增材制造的聚合物来克服目前占主导地位的COVID-19诊断方法的基本局限性。在本文中,我们回顾了几种不同类别的纳米材料和纳米化学如何实现简单的分析工作流程、高灵敏度、廉价的仪器、即时从样本到答案的病毒诊断和快速规模化生产。
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引用次数: 6
On amorphization as a deformation mechanism under high stresses 非晶化是高应力下的一种变形机制
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-02-01 DOI: 10.1016/j.cossms.2021.100976
Hosni Idrissi , Philippe Carrez , Patrick Cordier

In this paper we review the work related to amorphization under mechanical stress. Beyond pressure, we highlight the role of deviatoric or shear stresses. We show that the most recent works make amorphization appear as a deformation mechanism in its own right, in particular under extreme conditions (shocks, deformations under high stresses, high strain-rates).

本文综述了机械应力下非晶化的研究进展。除了压力,我们还强调了偏应力或剪应力的作用。我们表明,最近的研究表明,非晶化本身就是一种变形机制,特别是在极端条件下(冲击,高应力下的变形,高应变率)。
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引用次数: 15
Electrochemo-mechanical effects as a critical design factor for all-solid-state batteries 电化学-机械效应是全固态电池设计的关键因素
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-02-01 DOI: 10.1016/j.cossms.2021.100977
Yong Bae Song , Hiram Kwak , Woosuk Cho , Kyung Su Kim , Yoon Seok Jung , Kern-Ho Park

All-solid-state batteries (ASSBs) using inorganic solid electrolytes (SEs) are in the spotlight for next-generation energy storage devices because of their potential for outstanding safety and high energy density. Recent progress in this field has been primarily based on advances in materials, such as the discovery of SEs with high ionic conductivities and the improvement of interfacial stability in electrodes. However, the use of inelastic SEs causes severe electrochemo-mechanical failures, such as cathode active material (CAM) disintegration, CAM/SE contact loss, and stress build-up during cycling, deteriorating the Li+ and e transport pathways. Although these concerns have been addressed previously, they have not been contextualized systematically in terms of the mechanical interactions among the components and their impacts on electrochemical performance. Here, we categorize the electrochemo-mechanical effect in ASSBs and its ramifications in terms of stress sources, active materials, composite electrodes, and cell stacks.

使用无机固体电解质(SEs)的全固态电池(assb)因其出色的安全性和高能量密度的潜力而成为下一代储能设备的焦点。该领域的最新进展主要是基于材料的进步,例如发现具有高离子电导率的se和电极界面稳定性的改善。然而,非弹性SE的使用会导致严重的电化学机械故障,如阴极活性材料(CAM)解体、CAM/SE接触损失、循环过程中的应力积累、Li+和e−传输途径恶化。虽然这些问题之前已经解决了,但它们并没有在组件之间的机械相互作用及其对电化学性能的影响方面系统地背景化。在这里,我们从应力源、活性材料、复合电极和电池堆等方面对assb中的电化学-机械效应及其分支进行了分类。
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引用次数: 29
Nanostructured modified layered double hydroxides (LDHs)-based catalysts: A review on synthesis, characterization, and applications in water remediation by advanced oxidation processes 纳米结构修饰层状双氢氧化物(LDHs)催化剂:合成、表征及其在深度氧化法水体修复中的应用综述
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-02-01 DOI: 10.1016/j.cossms.2021.100965
Ansaf V. Karim , Aydin Hassani , Paria Eghbali , P.V. Nidheesh

Layered double hydroxides (LDHs) are emerging catalyst materials with inner layer water molecules and higher anion exchange capacity. They have been extensively used as catalyst materials owing to their high specific surface area, environmental friendliness, lower cost, and non-toxicity. However, the lower surface area and leaching of metal ions from LDHs composites reduce the process efficiency of the catalyst. Modifying the LDHs materials with other materials can improve the surface properties of the composite and enhance the catalytic performance. Herein, this review aims to summarize the recent progress of nanostructured modified LDHs materials, their classification, synthesis, and a detailed discussion on their characterization techniques. Further, this study also discusses the application of nanostructured modified LDHs materials as catalysts in advanced oxidation process (AOPs) for various organic pollutants removal.

层状双氢氧化物(LDHs)是一种具有内层水分子和较高阴离子交换能力的新型催化剂材料。它们具有比表面积大、环境友好、成本低、无毒等优点,被广泛用作催化剂材料。然而,较低的比表面积和LDHs复合材料中金属离子的浸出降低了催化剂的工艺效率。用其他材料对LDHs材料进行改性,可以改善复合材料的表面性能,提高催化性能。本文综述了近年来纳米结构改性LDHs材料的研究进展、分类、合成方法以及表征技术。此外,本研究还探讨了纳米结构改性LDHs材料作为催化剂在深度氧化过程(AOPs)中去除各种有机污染物的应用。
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引用次数: 134
The ionic interphases of the lithium anode in solid state batteries 固态电池中锂阳极的离子界面
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2022-02-01 DOI: 10.1016/j.cossms.2021.100973
Rui Guo, Gustavo M. Hobold, Betar M. Gallant

Solid state battery (SSB) performance is largely governed by processes occurring at electrolyte–electrode interfaces. At the Li metal anode, where the overwhelming majority of solid electrolyte (SE) are unstable against Li metal, the interface can readily react to form emergent Li-solid electrolyte interphases (SEI) with ionic, electronic, chemical, mechanical, and electrochemical properties substantially distinct from the parent phase. Facing similar challenges with liquid electrolytes, the Li battery community underwent a half century-long effort, still in progress, to illuminate fundamental properties of the Li SEI—including chemistry, morphology, transport, and sources of Li loss upon cycling—from which guiding principles have emerged to drive improvement in electrolyte and interface design. The Li metal SEI with solid electrolytes presents both similarities and differences to that in liquid electrolytes, with differences defining unique research needs. Here, we examine current understanding of the Li-SE interface as well as learnings from the liquid electrolyte community that we propose might be adopted to help rationalize and improve SE integration with Li anodes. Through this lens, we inspect current state-of-understanding of Li SEI composition, structure, and properties, along with Coulombic efficiency values reported so far for Li cycling with SE. We also highlight potential Li modification strategies for SSB, which are informed by and exploit understanding of the ionic SEI phases; in some instances, engineering strategies utilize a liquid electrolyte SEI directly, making liquid-derived SEI knowledge of immediate relevance.

固态电池(SSB)的性能在很大程度上取决于发生在电解质-电极界面上的过程。在锂金属阳极,绝大多数固体电解质(SE)对锂金属是不稳定的,界面可以很容易地反应形成紧急的锂-固体电解质界面相(SEI),其离子、电子、化学、机械和电化学性能与母相截然不同。面对液体电解质的类似挑战,锂电池界经历了长达半个世纪的努力,仍在进行中,以阐明Li sei的基本特性-包括化学,形态,运输和循环时Li损失的来源-从中出现了指导原则,以推动电解质和界面设计的改进。固体电解质下的锂金属SEI与液体电解质下的锂金属SEI既有相似之处,也有不同之处,不同之处决定了其独特的研究需求。在这里,我们研究了目前对Li-SE界面的理解,以及我们提出的可能用于帮助合理化和改善SE与Li阳极集成的液体电解质社区的学习。通过这一视角,我们考察了目前对Li SEI组成、结构和性质的理解状况,以及迄今为止报道的Li与SE循环的库仑效率值。我们还强调了SSB的潜在Li修饰策略,这些策略是通过对离子SEI相的理解来实现的;在某些情况下,工程策略直接利用液体电解质SEI,使液体衍生的SEI知识立即相关。
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引用次数: 5
Nanoparticle approaches against SARS-CoV-2 infection 抗SARS-CoV-2感染的纳米颗粒方法
IF 11 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY Pub Date : 2021-12-01 DOI: 10.1016/j.cossms.2021.100964
Yaou Duan, Shuyan Wang, Qiangzhe Zhang, Weiwei Gao, Liangfang Zhang

Coronavirus disease 2019 (COVID-19), caused by the highly contagious severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2), has become the worst pandemic disease of the current millennium. To address this crisis, therapeutic nanoparticles, including inorganic nanoparticles, lipid nanoparticles, polymeric nanoparticles, virus-like nanoparticles, and cell membrane-coated nanoparticles, have all offered compelling antiviral strategies. This article reviews these strategies in three categories: (1) nanoparticle-enabled detection of SARS-CoV-2, (2) nanoparticle-based treatment for COVID-19, and (3) nanoparticle vaccines against SARS-CoV-2. We discuss how nanoparticles are tailor-made to biointerface with the host and the virus in each category. For each nanoparticle design, we highlight its structure–function relationship that enables effective antiviral activity. Overall, nanoparticles bring numerous new opportunities to improve our response to the current COVID-19 pandemic and enhance our preparedness for future viral outbreaks.

由高度传染性的严重急性呼吸系统综合征冠状病毒2 (SARS-CoV-2)引起的2019冠状病毒病(COVID-19)已成为本世纪最严重的大流行疾病。为了解决这一危机,治疗性纳米颗粒,包括无机纳米颗粒、脂质纳米颗粒、聚合纳米颗粒、病毒样纳米颗粒和细胞膜包覆纳米颗粒,都提供了令人信服的抗病毒策略。本文从三个方面综述了这些策略:(1)基于纳米颗粒的SARS-CoV-2检测,(2)基于纳米颗粒的COVID-19治疗和(3)针对SARS-CoV-2的纳米颗粒疫苗。我们讨论了如何定制纳米颗粒来与每种类型的宿主和病毒进行生物界面。对于每个纳米颗粒设计,我们强调其结构-功能关系,使有效的抗病毒活性。总的来说,纳米颗粒为改善我们对当前COVID-19大流行的反应和加强我们对未来病毒爆发的准备带来了许多新的机会。
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引用次数: 17
期刊
Current Opinion in Solid State & Materials Science
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