Noble metal (Ag, Au, Pd and Pt) doped TaS2 monolayer for gas sensing: a first-principles investigation

2021 ◽  
Author(s):  
Jia Shi ◽  
Wenjing Quan ◽  
Xinwei Chen ◽  
Xiyu Chen ◽  
Yongwei Zhang ◽  
...  
Keyword(s):  
Work Function ◽  
Noble Metal ◽  
Gas Sensors ◽  
First Principles ◽  
Recovery Time ◽  
High Performance ◽  
Gas Sensing ◽  
Promising Candidate ◽  
Obvious Change ◽  
Short Recovery Time

Ag-doped TaS2 monolayers show an obvious change in work function and short recovery time for NO2, which indicates that TaS2-based nanomaterials might be a promising candidate for constructing high-performance NO2 gas sensors.

scholarly journals Optimization of a Low-Power Chemoresistive Gas Sensor: Predictive Thermal Modelling and Mechanical Failure Analysis

Sensors ◽  
2021 ◽  
Vol 21 (3) ◽  
pp. 783 ◽  
Author(s):  
Andrea Gaiardo ◽  
David Novel ◽  
Elia Scattolo ◽  
Michele Crivellari ◽  
Antonino Picciotto ◽  
...  
Keyword(s):  
Low Power ◽  
Failure Analysis ◽  
Gas Sensors ◽  
High Performance ◽  
Gas Sensing ◽  
Mechanical Failure ◽  
Sensing Applications ◽  
Theoretical Approaches ◽  
Sensing Material ◽  
Silicon Bulk

The substrate plays a key role in chemoresistive gas sensors. It acts as mechanical support for the sensing material, hosts the heating element and, also, aids the sensing material in signal transduction. In recent years, a significant improvement in the substrate production process has been achieved, thanks to the advances in micro- and nanofabrication for micro-electro-mechanical system (MEMS) technologies. In addition, the use of innovative materials and smaller low-power consumption silicon microheaters led to the development of high-performance gas sensors. Various heater layouts were investigated to optimize the temperature distribution on the membrane, and a suspended membrane configuration was exploited to avoid heat loss by conduction through the silicon bulk. However, there is a lack of comprehensive studies focused on predictive models for the optimization of the thermal and mechanical properties of a microheater. In this work, three microheater layouts in three membrane sizes were developed using the microfabrication process. The performance of these devices was evaluated to predict their thermal and mechanical behaviors by using both experimental and theoretical approaches. Finally, a statistical method was employed to cross-correlate the thermal predictive model and the mechanical failure analysis, aiming at microheater design optimization for gas-sensing applications.

scholarly journals Enhancing Formaldehyde Selectivity of SnO2 Gas Sensors with the ZSM-5 Modified Layers

Sensors ◽  
2021 ◽  
Vol 21 (12) ◽  
pp. 3947
Author(s):  
Wei Wang ◽  
Qinyi Zhang ◽  
Ruonan Lv ◽  
Dong Wu ◽  
Shunping Zhang
Keyword(s):  
Gas Sensors ◽  
Indoor Air ◽  
High Performance ◽  
Screen Printing ◽  
Gas Sensing ◽  
Oxide Semiconductors ◽  
Screen Printing Method ◽  
Gas Sensing Properties ◽  
Zeolite Films ◽  
Insufficient Knowledge

High performance formaldehyde gas sensors are widely needed for indoor air quality monitoring. A modified layer of zeolite on the surface of metal oxide semiconductors results in selectivity improvement to formaldehyde as gas sensors. However, there is insufficient knowledge on how the thickness of the zeolite layer affects the gas sensing properties. In this paper, ZSM-5 zeolite films were coated on the surface of the SnO2 gas sensors by the screen printing method. The thickness of ZSM-5 zeolite films was controlled by adjusting the numbers of screen printing layers. The influence of ZSM-5 film thickness on the performance of ZSM-5/SnO2 gas sensors was studied. The results showed that the ZSM-5/SnO2 gas sensors with a thickness of 19.5 μm greatly improved the selectivity to formaldehyde, and reduced the response to ethanol, acetone and benzene at 350 °C. The mechanism of the selectivity improvement to formaldehyde of the sensors was discussed.

Adsorption of the Gas Molecules (NH3, C2H6O, C3H6O, CO, H2S) on noble metal (Ag, Au, Pt, Pd, Ru)–Doped MoSe2 Monolayer: A First-Principles Study

2021 ◽  
Author(s):  
Lanjuan Zhou ◽  
Sujing Yu ◽  
Yan Yang ◽  
Qi Li ◽  
Tingting Li ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Noble Metal ◽  
First Principles ◽  
Density Functional ◽  
Noble Metals ◽  
Gas Sensing ◽  
Functional Theory ◽  
First Principles Study ◽  
Gas Molecules ◽  
Sensing Performance

In this paper, the effects of five noble metals (Au, Pt, Pd, Ag, Ru) doped MoSe2 on improving gas sensing performance were predicted through density functional theory (DFT) based on...

scholarly journals Oxygen-Deficient Stannic Oxide/Graphene for Ultrahigh-Performance Supercapacitors and Gas Sensors

Nanomaterials ◽  
2021 ◽  
Vol 11 (2) ◽  
pp. 372
Author(s):  
Liyang Lin ◽  
Susu Chen ◽  
Tao Deng ◽  
Wen Zeng
Keyword(s):  
Energy Storage ◽  
Gas Sensors ◽  
High Performance ◽  
Gas Sensing ◽  
Synthesis Method ◽  
Rate Capability ◽  
Stannic Oxide ◽  
Energy Storage Devices ◽  
Graphene Nanocomposites ◽  
Storage Devices

The metal oxides/graphene nanocomposites have great application prospects in the fields of electrochemical energy storage and gas sensing detection. However, rational synthesis of such materials with good conductivity and electrochemical activity is the topical challenge for high-performance devices. Here, SnO2/graphene nanocomposite is taken as a typical example and develops a universal synthesis method that overcome these challenges and prepares the oxygen-deficient SnO2 hollow nanospheres/graphene (r-SnO2/GN) nanocomposite with excellent performance for supercapacitors and gas sensors. The electrode r-SnO2/GN exhibits specific capacitance of 947.4 F g−1 at a current density of 2 mA cm−2 and of 640.0 F g−1 even at 20 mA cm−2, showing remarkable rate capability. For gas-sensing application, the sensor r-SnO2/GN showed good sensitivity (~13.8 under 500 ppm) and short response/recovering time toward methane gas. These performance features make r-SnO2/GN nanocomposite a promising candidate for high-performance energy storage devices and gas sensors.

scholarly journals First-Principles Study of Au-Doped InN Monolayer as Adsorbent and Gas Sensing Material for SF6 Decomposed Species

Nanomaterials ◽  
2021 ◽  
Vol 11 (7) ◽  
pp. 1708
Author(s):  
Ruochen Peng ◽  
Qu Zhou ◽  
Wen Zeng
Keyword(s):  
Power Systems ◽  
Molecular Orbital ◽  
First Principles ◽  
Recovery Time ◽  
Sulfur Hexafluoride ◽  
Gas Sensing ◽  
Normal Operation ◽  
Frontier Molecular Orbital ◽  
Adsorption System ◽  
Sensing Material

As an insulating medium, sulfur hexafluoride (SF6) is extensively applied to electrical insulation equipment to ensure its normal operation. However, both partial discharge and overheating may cause SF6 to decompose, and then the insulation strength of electrical equipment will be reduced. The adsorption properties and sensing mechanisms of four SF6 decomposed components (HF, SO2, SOF2 and SO2F2) upon an Au-modified InN (Au-InN) monolayer were studied in this work based on first-principles theory. Meanwhile, the adsorption energy (Ead), charge transfer (QT), deformation charge density (DCD), density of states (DOS), frontier molecular orbital and recovery property were calculated. It can be observed that the structures of the SO2, SOF2 and SO2F2 molecules changed significantly after being adsorbed. Meanwhile, the Ead and QT of these three adsorption systems are relatively large, while that of the HF adsorption system is the opposite. These phenomena indicate that Au-InN monolayer has strong adsorption capacity for SO2, SOF2 and SO2F2, and the adsorption can be identified as chemisorption. In addition, through the analysis of frontier molecular orbital, it is found that the conductivity of Au-InN changed significantly after adsorbing SO2, SOF2 and SO2F2. Combined with the analysis of the recovery properties, since the recovery time of SO2 and SO2F2 removal from Au-InN monolayer is still very long at 418 K, Au-InN is more suitable as a scavenger for these two gases rather than as a gas sensor. Since the recovery time of the SOF2 adsorption system is short at 418 K, and the conductivity of the system before and after adsorption changes significantly, Au-InN is an ideal SOF2 gas-sensing material. These results show that Au-InN has broad application prospects as an SO2, SOF2 and SO2F2 scavenger and as a resistive SOF2 sensor, which is of extraordinary meaning to ensure the safe operation of power systems. Our calculations can offer a theoretical basis for further exploration of gas adsorbent and resistive sensors prepared by Au-InN.

Fast response acetone-sensing properties of SnO2 nanoparticles prepared by the sol-gel method

2021 ◽  
Vol 93 (3) ◽  
pp. 30401
Author(s):  
Jiaxing Wang ◽  
Hai Yu ◽  
Yong Zhang
Keyword(s):  
High Performance ◽  
Gas Sensing ◽  
Sno2 Nanoparticles ◽  
Sol Gel ◽  
Fast Response ◽  
X Ray Diffraction ◽  
Gel Method ◽  
Sol Gel Method ◽  
Short Recovery Time ◽  
Acetone Gas Detection

SnO2 nanoparticle architectures were successfully synthesized using a sol-gel method and developed for acetone gas detection. The morphology and structure of the particles were characterized by X-ray diffraction (XRD) and scanning electron microscopy (SEM). The SnO2 nanoparticle architectures were configured as high-performance sensors to detect acetone and showed a very fast response time (<1 s), a short recovery time (10 s), good repeatability and high selectivity at a relatively low working temperature. Thus, SnO2 nanoparticles should be promising candidates for designing and fabricating acetone gas sensors with good gas sensing performance. The possible gas sensing mechanism is also presented.

Bridging or in-Plane Oxygen Vacancies for a High-Performance Chemoresistive Gas Sensors? a First-Principles Study

2020 ◽  
Vol MA2020-01 (28) ◽  
pp. 2111-2111
Author(s):  
Soufiane Krik ◽  
Andrea Gaiardo ◽  
Matteo Valt ◽  
Barbara Fabbri ◽  
Cesare Malagù ◽  
...  
Keyword(s):  
Gas Sensors ◽  
First Principles ◽  
High Performance ◽  
Oxygen Vacancies ◽  
First Principles Study

Hierarchically designed ZnO nanostructure based high performance gas sensors

RSC Advances ◽  
2014 ◽  
Vol 4 (90) ◽  
pp. 49521-49528 ◽  
Author(s):  
Mohammad R. Alenezi ◽  
T. H. Alzanki ◽  
A. M. Almeshal ◽  
A. S. Alshammari ◽  
M. J. Beliatis ◽  
...  
Keyword(s):  
Gas Sensors ◽  
High Performance ◽  
Gas Sensing ◽  
High Surface ◽  
Hierarchical Nanostructures ◽  
Sensing Properties ◽  
Zno Nanostructure ◽  
Gas Sensing Properties

Enhanced gas sensing properties of ZnO were achieved by designing hierarchical nanostructures with high surface-to-volume ratios and more exposed polar facets.

Fabrication of a Carbon Nanotube Gas Sensor Microelectrodes and its Application for Ammonia Detection

2013 ◽  
Vol 431 ◽  
pp. 306-311
Author(s):  
Xiang Tao Ran ◽  
Zhi Wang ◽  
Li Yang
Keyword(s):  
Gas Sensors ◽  
High Performance ◽  
Gas Sensing ◽  
Structural Parameters ◽  
Low Cost ◽  
Manufacturing Method ◽  
Multi Walled Carbon Nanotubes ◽  
Ammonia Detection ◽  
Low Cost Manufacturing ◽  
Walled Carbon Nanotubes

With the increasing needs for high-performance gas sensors in industrial production, environmental monitoring and so on, the research on gas sensors is becoming more and more important. In this paper, the electric field intensity distribution simulation process of the interdigital microelectrodes (IMEs) is discussed in details to get the proper electrode structural parameters. The IMEs on the ITO surface with a minimum gap of about 4μm are achieved by lithography, which provides a reliable, low-cost manufacturing method. Sensitive components are made of the multi-walled carbon nanotubes modified materials. The gas-sensing property of the sensor is detected for ammonia. The experiment result shows that the performance of the nanomodified sensor is obviously improved.

scholarly journals Nitrogen Dioxide Gas Sensor Based on Ag-Doped Graphene: A First-Principle Study

Chemosensors ◽  
2021 ◽  
Vol 9 (8) ◽  
pp. 227
Author(s):  
Qichao Li ◽  
Yamin Liu ◽  
Di Chen ◽  
Jianmin Miao ◽  
Xiao Zhi ◽  
...  
Keyword(s):  
Gas Sensor ◽  
Gas Sensors ◽  
High Performance ◽  
Density Functional ◽  
Noble Metals ◽  
Gas Sensing ◽  
Mulliken Charge ◽  
Chronic Obstructive ◽  
Doped Graphene ◽  
The Impact

High-performance tracking trace amounts of NO2 with gas sensors could be helpful in protecting human health since high levels of NO2 may increase the risk of developing acute exacerbation of chronic obstructive pulmonary disease. Among various gas sensors, Graphene-based sensors have attracted broad attention due to their sensitivity, particularly with the addition of noble metals (e.g., Ag). Nevertheless, the internal mechanism of improving the gas sensing behavior through doping Ag is still unclear. Herein, the impact of Ag doping on the sensing properties of Graphene-based sensors is systematically analyzed via first principles. Based on the density-functional theory (DFT), the adsorption behavior of specific gases (NO2, NH3, H2O, CO2, CH4, and C2H6) on Ag-doped Graphene (Ag–Gr) is calculated and compared. It is found that NO2 shows the strongest interaction and largest Mulliken charge transfer to Ag–Gr among these studied gases, which may directly result in the highest sensitivity toward NO2 for the Ag–Gr-based gas sensor.

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