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Design and implementation of a measuring system used to evaluate the mechanical performance of the bone fixators 设计和实现一个测量系统,用于评估骨固定物的机械性能
4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-10-23 DOI: 10.1108/sr-08-2021-0233
Zhanshe Guo, Xiangdang Liang, Sen Wang
Purpose This measuring system is designed to effectively simulate the mechanical reliability of the operated bone fixators. It can be used to pre-evaluate the mechanical performance of the operated fixator on the patients, including the static mechanical properties and fatigue properties when the patient walks after the operation. Design/methodology/approach It is mainly composed of a one-dimensional platform, a force sensor, a high measuring precision displacement sensor and a servo motor. Loading (which is used to simulate the loading status of the fixators after the operation) of the system is realized by the rotation of the servo motor. It can be read by a high precision force sensor. The relative displacement of the broken bone is obtained by a high precision laser displacement sensor. Corresponding theoretical analysis is also carried out. Findings Calibrated results of the system indicate that the output voltage and the measured force of the force sensors possess an excellent linear relationship, and the calculated nonlinear error is just 0.0002%. The maximum relative displacement between the operated broken bone under 700 N axial force is about 1 mm. Fatigue test under 550 N loading for 85,000 cycles also indicates the feasibility of the design. Originality/value This device is successfully designed and fabricated to pre-evaluate the mechanical performance of the bone fixators. High precision force sensor and displacement sensor are used to successfully increase the measuring ability of the system. This will offer some help to pertinent researchers.
目的设计该测量系统以有效模拟骨固定架的机械可靠性。可用于预评估手术后固定架对患者的力学性能,包括患者术后行走时的静态力学性能和疲劳性能。它主要由一维平台、力传感器、高测量精度位移传感器和伺服电机组成。系统的加载(用于模拟夹具运行后的加载状态)是通过伺服电机的旋转来实现的。它可以通过高精度力传感器读取。采用高精度激光位移传感器测量骨折的相对位移。并进行了相应的理论分析。系统标定结果表明,力传感器输出电压与测力具有良好的线性关系,计算出的非线性误差仅为0.0002%。在700 N轴向力作用下,手术骨折之间的最大相对位移约为1 mm。550n载荷下8.5万次疲劳试验也验证了设计的可行性。该装置被成功设计和制造,用于预评估骨固定物的机械性能。采用高精度力传感器和位移传感器,成功地提高了系统的测量能力。这将为相关研究人员提供一些帮助。
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引用次数: 0
Ultra sensitive determination of Cadmium (II) using Ag-Au BMNPs–aptamer–modified glassy carbon electrodes (GCE) Ag-Au -适配体修饰玻碳电极超灵敏测定镉(II)
4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-10-16 DOI: 10.1108/sr-07-2022-0267
Reetu Yadav, Mamta Kushwah, Anna Nikolaevna Berlina, Mulayam Singh Gaur
Purpose The purpose of this study is determination of cadmium using silver-gold bimetallic nanoparticles (Ag-Au BMNPs) and an aptamer modified glassy carbon electrode. Design/methodology/approach The maximum response of modified electrode was obtained with, 50 mV pulse amplitude, 20 mV/s scan rate in phosphate buffer of pH 4.0. Ag-Au BMNPs, as the mediators improved electron transmit during the entire electron transfer process and the aptasensor response. Herein, the authors used aptamer as the capture probe to prepare an aptasensor with enhanced stability. Findings The proposed aptasensor exhibited a wide linearity to cadmium in the range of 0.001–0.100 µg/L with a low detection limit of 0.005×10 −3 µg/L. The glassy carbon electrodes with Ag-Au BMNPs showed a lower detection limit. Originality/value This aptasensor has good reproducibility, stability and repeatability and is cost-effective to regenerate. The specificity and selectivity of the novel modified electrode is tested in the presence of other interfering metal ions such as Fe 2+ , Mn 2+ , Mg 2+ , Sb 3+ and Bi 3+ . The aptasensor shows 10 times more sensitivity and selectivity for Cd 2+ ions.
目的研究银金双金属纳米粒子(Ag-Au BMNPs)和适体修饰的玻碳电极测定镉的方法。在pH为4.0的磷酸盐缓冲液中,当脉冲振幅为50 mV,扫描速率为20 mV/s时,改性电极的响应最大。Ag-Au BMNPs作为介质,在整个电子传递过程中提高了电子传递率,提高了适体传感器的响应。本文采用适体作为捕获探针,制备了具有增强稳定性的适体传感器。在0.001 ~ 0.100µg/L的线性范围内,检测限低至0.005×10−3µg/L。Ag-Au BMNPs的玻碳电极检测限较低。原创性/价值该传感器具有良好的再现性、稳定性和可重复性,再生成本低。在fe2 +、mn2 +、mg2 +、sb3 +、bi3 +等干扰金属离子存在的情况下,测试了新型修饰电极的特异性和选择性。该传感器对cd2 +离子的灵敏度和选择性提高了10倍。
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引用次数: 0
Use of highly sensitive nickel phthalocyanine based humidity sensor to explore the imprecise data analysis for robot body 利用高灵敏度的酞菁镍湿度传感器,探索机器人身体的不精确数据分析
4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-10-02 DOI: 10.1108/sr-12-2022-0442
Usama Afzal, Kanza Maryam, Fatima Afzal, Muhammad Aslam
Purpose The purpose of this study is to fabricate a highly sensitive humidity sensor for observing the humidity effect on a robot’s body as an application of the Internet of Things. The sensor has been fabricated by depositing a thin sensing layer of nickel phthalocyanine (NiPc) between two silver electrodes. Design/methodology/approach The structure of the thin film was observed by X-ray diffraction, optical properties by UV Vis and surface morphology by scanning electron microscope. The capacitance and the resistance with respect to change in relative humidity from 0 to 100%RH have been measured by LCR meter at 1 kHz. Findings The sensor’s response time is 7.5 s and its recovery time is 3.7 s, with high sensitivity of 127,259 pF/%RH and 332.287 MΩ/%RH. The authors have also used a proposed sensor on a steel body and observed humidity values. The analysis of all measured values was performed through the classical and neutrosophic approaches. By comparing, the authors have observed that the neutrosophic approach is more efficient in analyzing the sensor data. Originality/value In this work, the authors will fabricate a capacitive and resistive-type humidity sensor using the thin film of NiPc. The structural, optical and morphological properties of NiPc thin film will be investigated with different characterization techniques. The electric properties, i.e. capacitance and resistance, will be measured at intervals with an LCR meter by changing relative humidity (%RH). Moreover, the measured data will be analyzed through different statistical approaches, as already used in [12].
本研究的目的是制造一种高灵敏度的湿度传感器,用于观察机器人身体的湿度效应,作为物联网的应用。该传感器是通过在两个银电极之间沉积一层薄薄的酞菁镍(NiPc)来制造的。采用x射线衍射法、紫外可见光谱法和扫描电镜法分别对薄膜的结构、光学性质和表面形貌进行了观察。用LCR计在1khz下测量了相对湿度从0到100%RH变化时的电容和电阻。结果该传感器的响应时间为7.5 s,恢复时间为3.7 s,灵敏度分别为127,259 pF/%RH和332.287 MΩ/%RH。作者还在钢体上使用了一种传感器,并观察了湿度值。所有测量值的分析均通过经典和嗜中性方法进行。通过比较,作者观察到中性粒细胞方法在分析传感器数据时更有效。在这项工作中,作者将利用NiPc薄膜制造一种电容式和电阻式湿度传感器。采用不同的表征技术,研究了NiPc薄膜的结构、光学和形态特性。电性能,即电容和电阻,将通过改变相对湿度(%RH)每隔一段时间用LCR计测量一次。此外,测量数据将通过不同的统计方法进行分析,如[12]中已经使用的。
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引用次数: 0
A parallel ring-ring capacitive proximity sensor for detection of approaching conductor 一种用于探测接近导体的并联环形电容式接近传感器
4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-09-12 DOI: 10.1108/sr-03-2023-0056
Yanyan Shi, Fenglan Huang, Meng Wang, Yongheng Li
Purpose To solve the problem of low sensitivity of traditional capacitive proximity sensor, this paper aims to propose a novel capacitive sensor for detection of an approaching conductor. Design/methodology/approach Five capacitive proximity sensors with different structures are designed and the performance is compared with the traditional capacitive sensor. The impacts of geometrical parameters on the performance of the proposed capacitive sensor are studied. Furthermore, the sensitivity of the proposed capacitive sensor to an approaching conductor with different sizes is discussed. Also, how the designed capacitive sensor is sensitive to the lateral placement of the approaching object is analyzed. Findings Several capacitive proximity sensor structures have been designed and analyzed. It is found that the capacitive sensor with the top small ring-bottom large ring structure shows stronger electric field distribution around the top electrode and higher sensitivity to the approaching conductor than other sensors. Through further analysis of the proposed sensor, the results demonstrate that proposed capacitive sensor is effective for proximity object detection. Originality/value This paper proposes a novel capacitive proximity sensor with top small ring-bottom large ring structure. Compared with the traditional capacitive sensor, the proposed capacitive sensor is more sensitive to the approaching object. This would be helpful for the accurate detection of the approaching object. Also, the top and bottom electrodes are much smaller.
为了解决传统电容式接近传感器灵敏度低的问题,提出了一种新型的电容式接近传感器。设计了五种不同结构的电容式接近传感器,并与传统电容式传感器进行了性能比较。研究了几何参数对电容式传感器性能的影响。此外,还讨论了所提出的电容式传感器对接近的不同尺寸导体的灵敏度。同时,分析了所设计的电容式传感器如何对接近物体的横向位置敏感。结果设计并分析了几种电容式接近传感器结构。研究发现,上小环-下大环结构的电容式传感器在上电极周围具有更强的电场分布,对接近导体的灵敏度高于其他传感器。通过对所提出传感器的进一步分析,结果表明所提出的电容式传感器对近距离目标检测是有效的。提出了一种上小环下大环结构的电容式接近传感器。与传统的电容式传感器相比,所提出的电容式传感器对接近的物体更加敏感。这将有助于准确探测接近的物体。此外,顶部和底部电极也小得多。
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引用次数: 0
A micro room temperature oxygen sensor based on LaF3 solid electrolyte thin film 基于LaF3固体电解质薄膜的微型室温氧传感器
IF 1.6 4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-08-24 DOI: 10.1108/sr-02-2021-0044
Yankun Tang, M. Zhang, Kedong Chen, Sher Ali Nawaz, Hairong Wang, Jiuhong Wang, Xianqing Tian
PurposeDetecting O2 gas in a confined space at room temperature is particularly important to monitor the work process of precision equipment. This study aims to propose a miniaturized, low-cost, mass-scale produced O2 sensor operating around 30°C.Design/methodology/approachThe O2 sensor based on lanthanum fluoride (LaF3) solid electrolyte thin film was developed using MEMS technology. The principle of the sensor was a galvanic cell H2O, O2, Pt | LaF3 | Sn, SnF2 |, in which the Sn film was prepared by magnetron sputtering, and the LaF3 film was prepared by thermal resistance evaporation.FindingsThrough pretreatments, the sensor’s response signal to 40% oxygen concentration was enhanced from 1.9 mV to 46.0 mV at 30°C and 97.0% RH. Tests at temperatures from 30°C to 50°C and humidity from 32.4% RH to 97.0% RH indicated that the output electromotive force (EMF) has a linear relationship with the logarithm of the oxygen concentration. The sensitivity of the sensor increases with an increase in both humidity and temperature in the couple mode, and the EMF of the sensor follows well with the Nernst equation at different temperatures and humidity.Practical implicationsThis research could be applied to monitor the oxygen concentration below 25% in confined spaces at room temperature safely without a power supply.Originality/valueThe relationship between temperature and humidity coupling and the response of the sensor was obtained. The nano-film material was integrated with the MEMS process. It is expected to be practically applied in the future.
目的在室温下密闭空间内检测氧气气体对监测精密设备的工作过程尤为重要。本研究旨在提出一种工作在30°C左右的小型化、低成本、大规模生产的O2传感器。采用MEMS技术,研制了基于氟化镧(LaF3)固体电解质薄膜的O2传感器。传感器的原理为原电池H2O, O2, Pt | LaF3 | Sn, SnF2 |,其中Sn薄膜采用磁控溅射法制备,LaF3薄膜采用热阻蒸发法制备。在30℃、97.0% RH条件下,通过预处理,传感器对40%氧浓度的响应信号由1.9 mV增强到46.0 mV。在温度为30℃~ 50℃,湿度为32.4% ~ 97.0% RH的条件下进行的测试表明,输出电动势(EMF)与氧浓度的对数呈线性关系。在耦合模式下,传感器的灵敏度随湿度和温度的增加而增加,传感器的电动势在不同温度和湿度下都符合能思特方程。实际意义本研究可应用于室温下密闭空间内,在没有电源的情况下安全监测氧气浓度低于25%。获得了温湿度耦合与传感器响应之间的关系。纳米薄膜材料与MEMS工艺相结合。期望在未来得到实际应用。
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引用次数: 0
Wearable sensors for human activity recognition based on a self-attention CNN-BiLSTM model 基于自关注CNN-BiLSTM模型的人类活动识别可穿戴传感器
IF 1.6 4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-08-23 DOI: 10.1108/sr-10-2022-0398
Huafeng Guo, Changcheng Xiang, Shiqiang Chen
PurposeThis study aims to reduce data bias during human activity and increase the accuracy of activity recognition.Design/methodology/approachA convolutional neural network and a bidirectional long short-term memory model are used to automatically capture feature information of time series from raw sensor data and use a self-attention mechanism to learn select potential relationships of essential time points. The proposed model has been evaluated on six publicly available data sets and verified that the performance is significantly improved by combining the self-attentive mechanism with deep convolutional networks and recursive layers.FindingsThe proposed method significantly improves accuracy over the state-of-the-art method between different data sets, demonstrating the superiority of the proposed method in intelligent sensor systems.Originality/valueUsing deep learning frameworks, especially activity recognition using self-attention mechanisms, greatly improves recognition accuracy.
目的本研究旨在减少人类活动中的数据偏差,提高活动识别的准确性。设计/方法论/方法卷积神经网络和双向长短期记忆模型用于从原始传感器数据中自动捕获时间序列的特征信息,并使用自注意机制来学习关键时间点的选择潜在关系。所提出的模型已经在六个公开可用的数据集上进行了评估,并验证了通过将自关注机制与深度卷积网络和递归层相结合,性能显著提高。发现与最先进的方法相比,所提出的方法在不同数据集之间显著提高了精度,证明了所提出方法在智能传感器系统中的优越性。独创性/价值使用深度学习框架,特别是使用自我注意机制的活动识别,大大提高了识别的准确性。
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引用次数: 0
Design and simulation of a MEMS-based piezoelectric micropump for bio-medical applications 生物医学用mems压电微泵的设计与仿真
IF 1.6 4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-08-14 DOI: 10.1108/sr-01-2023-0004
Sajjad Habashi Youvalari, Arash Olianezhad, S. Afrang
PurposeThe purpose of this paper is to design and simulate a piezoelectric micropump using microelectromechanical systems technology for drug delivery applications.Design/methodology/approachTwo piezoelectric actuators are used to actuate and bend the diaphragms in the proposed structure. In this micropump, the liquid flow is rectified by two silicon check valves.FindingsThe use of two piezoelectric transducer (PZT) actuators in the parallel mod not only reduces dead volume but also increases stroke volume as well. In addition to increasing the flow rate, this phenomenon enhances the operation of the micropump to have self-priming as smoothly as possible.Originality/valueThis actuating method results in a 22% increase in flow rate and compression ratio, as well as a 15% reduction in function voltage. The fluid-solid interaction is simulated using COMSOL Multiphysics 5.3a.
目的利用微机电系统技术设计并仿真了一种用于药物输送的压电微泵。设计/方法/方法使用两个压电致动器来驱动和弯曲所提出的结构中的隔膜。在这种微型泵中,液体流动由两个硅止回阀进行整流。在并联模式中使用两个压电换能器(PZT)作动器不仅减少了死区体积,而且增加了行程体积。除了增加流量外,这种现象还增强了微泵的运行,使其尽可能平稳地自吸。独创性/价值这种驱动方法使流量和压缩比增加22%,功能电压降低15%。采用COMSOL Multiphysics 5.3a软件对流固相互作用进行模拟。
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引用次数: 0
New design of rotating eddy current probe for arbitrary orientation cracks detection 用于任意方位裂纹检测的旋转涡流探头的新设计
IF 1.6 4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-08-01 DOI: 10.1108/sr-01-2023-0012
F. Barrarat, K. Rayane, B. Helifa, S. Bensaid, I. Lefkaier
PurposeDetecting the orientation of cracks is a major challenge in the development of eddy current nondestructive testing probes. Eddy current-based techniques are limited in their ability to detect cracks that are not perpendicular to induced current flows. This study aims to investigate the application of the rotating electromagnetic field method to detect arbitrary orientation defects in conductive nonferrous parts. This method significantly improves the detection of cracks of any orientation.Design/methodology/approachA new rotating uniform eddy current (RUEC) probe is presented. Two exciting pairs consisting of similar square-shaped coils are arranged orthogonally at the same lifting point, thus avoiding further adjustment of the excitation system to generate a rotating electromagnetic field, eliminating any need for mechanical rotation and focusing this field with high density. A circular detection coil serving as a receiver is mounted in the middle of the excitation system.FindingsA simulation model of the rotating electromagnetic field system is performed to determine the rules and characteristics of the electromagnetic signal distribution in the defect area. Referring to the experimental results aimed to detect artificial cracks at arbitrary angles in underwater structures using the rotating alternating current field measurement (RACFM) system in Li et al. (2016), the model proposed in this paper is validated.Originality/valueCEDRAT FLUX 3D simulation results showed that the proposed probe can detect cracks with any orientation, maintaining the same sensitivity, which demonstrates its effectiveness. Furthermore, the proposed RUEC probe, associated with the exploitation procedure, allows us to provide a full characterization of the crack, namely, its length, depth and orientation in a one-pass scan, by analyzing the magnetic induction signal.
目的检测裂纹的方向是涡流无损检测探头发展的主要挑战。基于涡流的技术在检测不垂直于感应电流的裂缝方面受到限制。本研究旨在探讨旋转电磁场法在导电有色金属零件任意取向缺陷检测中的应用。该方法显著提高了对任意方向裂纹的检测效果。提出了一种新型旋转均匀涡流(RUEC)探头。由相似的方形线圈组成的两对激励对在同一提升点上正交排列,从而避免了励磁系统进一步调整以产生旋转电磁场,无需机械旋转并高密度聚焦该场。作为接收器的圆形检测线圈安装在励磁系统的中间。建立了旋转电磁场系统的仿真模型,确定了缺陷区域电磁信号分布的规律和特征。参考Li et al.(2016)利用旋转交变场测量(RACFM)系统检测水下构筑物任意角度人工裂缝的实验结果,对本文模型进行了验证。三维仿真结果表明,所提出的探针可以检测任意方向的裂缝,并保持相同的灵敏度,证明了其有效性。此外,所提出的RUEC探针与开发程序相关联,使我们能够通过分析磁感应信号,在一次扫描中提供裂缝的完整特征,即其长度,深度和方向。
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引用次数: 0
Interdigital flexible tactile sensor based on Velostat 基于Velostat的数字柔性触觉传感器
IF 1.6 4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-08-01 DOI: 10.1108/sr-01-2023-0009
Haifeng Fang, Yangyang Wei, Shuo Dong
PurposeTactile sensation is an important sensory function for robots in contact with the external environment. To better acquire tactile information about objects, this paper aims to propose a three-layer structure of the interdigital flexible tactile sensor.Design/methodology/approachThe sensor consists of a bottom electrode layer, a middle pressure-sensitive layer and a top indenter layer. First, the pressure sensitive material, structure design, fabrication process and circuit design of the sensor are introduced. Then, the calibration and performance test of the designed sensor is carried out. Four functions are used to fit and calibrate the relationship between the output voltage of the sensor and the contact force. Finally, the contact force sensing test of different weight objects and the flexible test of the sensor are carried out.FindingsThe performance test results show that the sensitivity of the sensor is 0.93 V/N when it is loaded with 0–3 N and 0.23 V/N when it is loaded with 3–5 N. It shows good repeatability, and the cross-interference between the sensing units is generally low. The contact force sensing test results of different weight objects show that the proposed sensor performs well in contact force. Each part of the sensor is a flexible material, allowing the sensor to achieve bending deformation, so that the sensor can better perceive the contact signs of the grasped object.Practical implicationsThe sensor can paste the surface of the paper robot’s gripper to measure the contact force of the grasping object and estimate the contour of the object.Originality/valueIn this paper, a three-layer interdigital flexible tactile sensor is proposed, and the structural parameters of the interdigital electrode are designed to improve the sensitivity and response speed of the sensor. The indenter with three shapes of the prism, square cylinder and hemisphere is preliminarily designed and the prism indenter with better conduction force is selected through finite element analysis, which can concentrate the external force in the sensing area to improve the sensitivity. The sensor designed in this paper can realize the measurement of contact force, which provides a certain reference for the field of robot tactile.
目的:运动感觉是机器人与外界环境接触时的一项重要感觉功能。为了更好地获取物体的触觉信息,本文提出了一种三层结构的数字间柔性触觉传感器。该传感器由底部电极层、中间压敏层和顶部压头层组成。首先介绍了传感器的压敏材料、结构设计、制作工艺和电路设计。然后,对所设计的传感器进行了标定和性能测试。使用四个函数拟合和校准传感器输出电压与接触力之间的关系。最后,进行了不同重量物体的接触力传感试验和传感器的柔性试验。性能测试结果表明,该传感器在0 ~ 3 N负载下的灵敏度为0.93 V/N,在3 ~ 5 N负载下的灵敏度为0.23 V/N。它具有良好的重复性,并且传感单元之间的交叉干扰一般较低。不同重量物体的接触力传感试验结果表明,该传感器具有良好的接触力传感性能。传感器的每个部分都是柔性材料,允许传感器实现弯曲变形,从而使传感器更好地感知被抓取物体的接触迹象。该传感器可以粘贴在造纸机器人的夹持器表面,测量抓取物体的接触力,估计物体的轮廓。提出了一种三层数字间柔性触觉传感器,设计了数字间电极的结构参数,提高了传感器的灵敏度和响应速度。初步设计了棱柱形、方圆柱形和半球形三种形状的压头,并通过有限元分析选择了传导力较好的棱柱形压头,将外力集中在传感区域,提高了灵敏度。本文设计的传感器可以实现接触力的测量,为机器人触觉领域提供一定的参考。
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引用次数: 0
Graphene-based resistant sensor decorated with Mn, Co, Cu for nitric oxide detection: Langmuir adsorption & DFT method 用锰、钴、铜修饰的石墨烯基电阻传感器检测一氧化氮:Langmuir吸附和DFT方法
IF 1.6 4区 工程技术 Q3 INSTRUMENTS & INSTRUMENTATION Pub Date : 2023-06-13 DOI: 10.1108/sr-03-2023-0040
Fatemeh Mollaamin, M. Monajjemi
PurposeThe purpose of this paper is to investigate the ability of transition metals (TMs) of iron-, nickel- and zinc-doped graphene nanosheet for adsorption of toxic gas of nitric oxide (NO). The results of this paper have provided a favorable understanding of the interaction between TM-doped graphene nanosheet and NO molecule.Design/methodology/approachA high performance of TM-doped graphene nanosheet as a gas sensor is demonstrated by modeling the material’s transport characteristics by means of the Langmuir adsorption and three-layered ONIOM/ density functional theory method. The Langmuir adsorption model has been done with a three-layered ONIOM using CAM-B3LYP functional and LANL2DZ and 6–311G (d, p) basis sets by Gaussian 16 revision C.01 program towards the formation of of NO→TM(Mn, Co, Cu)-doped on the Gr nanosheet.FindingsThe changes of charge density for Langmuir adsorption of NO on Mn-, Co- and Cu-doped graphene nanosheet orderly have been achieved as: ΔQCo-doped = +0.309 >> ΔQMn-doped = −0.074 > ΔQCu-doped = −0.051. Therefore, the number of changes of charge density have concluded a more remarkable charge transfer for Mn-doped graphene nanosheet. However, based on nuclear magnetic resonance spectroscopy, the sharp peaks around Cu doped on the surface of graphene nanosheet and C19 close to junction of N2 and Co17 have been observed. In addition, Cu-doped graphene sheet has a large effect on bond orbitals of C8–Cu 17, C15–Cu 17 and C16–Cu17 in the adsorption of NO on the Cu-doped/Gr which has shown the maximum occupancy. The amounts of ΔGads,NO→Mn−Co through IR computations based on polarizability have exhibited that ΔGads,NO→Mn−Co has indicated the most energy gap because of charge density transfer from the nitrogen atom in NO to Mn-doped graphene nanosheet, though ΔG(NO→Cu−C)0> ΔG(NO→Co−C)0>ΔG(NO→Mn−C)0.Originality/valueThis research aims to explore the adsorption of hazardous pollutant gas of “NO” by using carbon nanostructure doped by “TM” of iron, nickel and zinc to evaluate the effectiveness of adsorption parameters of various TM-doped graphene nanosheets.
目的研究掺杂铁、镍和锌的过渡金属石墨烯纳米片对一氧化氮(NO)有毒气体的吸附能力。本文的研究结果为研究掺杂tm的石墨烯纳米片与NO分子之间的相互作用提供了有利的认识。通过Langmuir吸附和三层niom /密度泛函理论方法对材料的输运特性进行建模,证明了tm掺杂石墨烯纳米片作为气体传感器的高性能。采用高斯16修正C.01程序,利用CAM-B3LYP功能层和LANL2DZ及6-311G (d, p)基集,建立了三层niom在Gr纳米片上NO→TM(Mn, Co, Cu)掺杂形成的Langmuir吸附模型。在Mn-、Co-和cu掺杂的石墨烯纳米片上,NO在Langmuir吸附过程中电荷密度的变化规律为:ΔQCo-doped = +0.309 >> ΔQMn-doped =−0.074 > ΔQCu-doped =−0.051。因此,电荷密度的变化次数得出了mn掺杂石墨烯纳米片的电荷转移更为显著的结论。然而,基于核磁共振波谱,在石墨烯纳米片表面Cu掺杂和C19靠近N2和Co17交界处的周围观察到尖锐的峰。此外,cu掺杂石墨烯片对C8-Cu 17、C15-Cu 17和C16-Cu17在cu掺杂/Gr上吸附NO时的键轨道影响较大,占据率最大。通过基于极化率的红外计算,ΔGads,NO→Mn−Co的量表明,ΔGads,NO→Mn−Co由于电荷密度从NO中的氮原子转移到Mn掺杂的石墨烯纳米片上,虽然ΔG(NO→Cu−C)0> ΔG(NO→Co−C)0>ΔG(NO→Mn−C)0,但由于电荷密度从NO转移到Mn掺杂的石墨烯纳米片上,其能隙最大。本研究旨在探索掺杂铁、镍、锌“TM”的碳纳米结构对“NO”有害污染物气体的吸附,评价不同掺杂TM的石墨烯纳米片吸附参数的有效性。
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引用次数: 5
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Sensor Review
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