• 文献检索
  • 文档翻译
  • 深度研究
  • 学术资讯
  • Suppr Zotero 插件Zotero 插件
  • 邀请有礼
  • 套餐&价格
  • 历史记录
应用&插件
Suppr Zotero 插件Zotero 插件浏览器插件Mac 客户端Windows 客户端微信小程序
定价
高级版会员购买积分包购买API积分包
服务
文献检索文档翻译深度研究API 文档MCP 服务
关于我们
关于 Suppr公司介绍联系我们用户协议隐私条款
关注我们

Suppr 超能文献

核心技术专利:CN118964589B侵权必究
粤ICP备2023148730 号-1Suppr @ 2026

文献检索

告别复杂PubMed语法,用中文像聊天一样搜索,搜遍4000万医学文献。AI智能推荐,让科研检索更轻松。

立即免费搜索

文件翻译

保留排版,准确专业,支持PDF/Word/PPT等文件格式,支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述,25分钟生成高质量综述,智能提取关键信息,辅助科研写作。

立即免费体验

监测现代农业中的气体含量:MoS 掺杂 GeSe 单层对 CO 的吸附行为和传感性能的密度泛函理论研究。

Monitoring Gases Content in Modern Agriculture: A Density Functional Theory Study of the Adsorption Behavior and Sensing Properties of CO on MoS Doped GeSe Monolayer.

机构信息

College of Engineering and Technology, Southwest University, Chongqing 400716, China.

School of Computer Science & Technology, Beijing Institute of Technology, Beijing 100081, China.

出版信息

Sensors (Basel). 2022 May 19;22(10):3860. doi: 10.3390/s22103860.

DOI:10.3390/s22103860
PMID:35632267
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC9144932/
Abstract

The reasonable allocation and control of CO concentration in a greenhouse are very important for the optimal growth of crops. In this study, based on density functional theory (DFT), an MoS-GeSe monolayer was proposed to unravel the issues of the lower selectivity, poorer sensitivity and non-recyclability of traditional nanomaterial gas sensors. The incorporation of MoS units greatly enhanced the sensitivity of the pure GeSe monolayer to CO and the high binding energy also demonstrated the thermal stability of the doped structures. The ideal adsorption energy, charge transfer and recovery time ensured that the MoS-GeSe monolayer had a good adsorption and desorption ability. This paper aimed to solve the matter of recycling sensors within agriculture. This research could provide the theoretical basis for the establishment of a potentially new generation of gas sensors for the monitoring of crop growth.

摘要

温室中 CO 浓度的合理分配和控制对作物的最佳生长非常重要。在这项研究中,基于密度泛函理论(DFT),提出了 MoS-GeSe 单层来解决传统纳米材料气体传感器选择性较低、灵敏度较差和不可回收的问题。MoS 单元的掺入极大地提高了纯 GeSe 单层对 CO 的灵敏度,而高结合能也证明了掺杂结构的热稳定性。理想的吸附能、电荷转移和恢复时间确保了 MoS-GeSe 单层具有良好的吸附和解吸能力。本文旨在解决农业中传感器的回收问题。这项研究可为监测作物生长的新一代潜在气体传感器的建立提供理论基础。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/ea64972e20ba/sensors-22-03860-g005.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/768e11c97354/sensors-22-03860-g001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/413f4fee9069/sensors-22-03860-g002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/5bd4330645aa/sensors-22-03860-g003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/3ebc2fe03ea3/sensors-22-03860-g004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/ea64972e20ba/sensors-22-03860-g005.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/768e11c97354/sensors-22-03860-g001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/413f4fee9069/sensors-22-03860-g002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/5bd4330645aa/sensors-22-03860-g003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/3ebc2fe03ea3/sensors-22-03860-g004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5439/9144932/ea64972e20ba/sensors-22-03860-g005.jpg

相似文献

1
Monitoring Gases Content in Modern Agriculture: A Density Functional Theory Study of the Adsorption Behavior and Sensing Properties of CO on MoS Doped GeSe Monolayer.监测现代农业中的气体含量:MoS 掺杂 GeSe 单层对 CO 的吸附行为和传感性能的密度泛函理论研究。
Sensors (Basel). 2022 May 19;22(10):3860. doi: 10.3390/s22103860.
2
Adsorption Behavior of Dissolved Gas Molecules in Transformer Oil on Rh Modified GeSe Monolayer.溶解在变压器油中的气体分子在Rh修饰的GeSe单层上的吸附行为
ACS Omega. 2024 Jan 31;9(6):7061-7068. doi: 10.1021/acsomega.3c09001. eCollection 2024 Feb 13.
3
Environmentally hazardous gas sensing ability of MoS-nanotubes: an insight from the electronic structure and transport properties.二硫化钼纳米管对环境有害气体的传感能力:基于电子结构和输运性质的洞察
Nanoscale Adv. 2021 Jul 6;3(15):4528-4535. doi: 10.1039/d0na01037e. eCollection 2021 Jul 27.
4
Photoactivated Mixed In-Plane and Edge-Enriched p-Type MoS Flake-Based NO Sensor Working at Room Temperature.光激活混合面内和面外富集 p 型 MoS 薄片室温 NO 传感器。
ACS Sens. 2018 May 25;3(5):998-1004. doi: 10.1021/acssensors.8b00146. Epub 2018 Apr 23.
5
Adsorption and Gas-Sensing Properties of Ag (n = 1-4) Cluster Doped GeSe for CH and CO Gases in Oil-Immersed Transformer.油浸变压器中用于检测CH和CO气体的Ag (n = 1-4) 团簇掺杂GeSe的吸附及气敏特性
Nanomaterials (Basel). 2022 Nov 26;12(23):4203. doi: 10.3390/nano12234203.
6
Theoretical Study of Small Molecules Adsorption on Pristine and Transition Metal Doped GeSe Monolayer for Gas Sensing Application.用于气体传感应用的小分子在原始和过渡金属掺杂的GeSe单层上吸附的理论研究
Langmuir. 2022 Jan 25;38(3):1287-1295. doi: 10.1021/acs.langmuir.1c03232. Epub 2022 Jan 12.
7
Capturing Carbon Dioxide by Co-Decorated Molybdenum Disulfide: Boosting Efficiency Achievement of a Porous Two-Dimensional Nanomaterial via DFT Study.通过共修饰二硫化钼捕获二氧化碳:通过 DFT 研究提高多孔二维纳米材料的效率实现。
Langmuir. 2023 Jul 18;39(28):9638-9647. doi: 10.1021/acs.langmuir.3c00579. Epub 2023 Jul 3.
8
Substitutional Coinage Metals as Promising Defects for Adsorption and Detection of Gases on MoS Monolayers: A Computational Approach.取代型金属作为 MoS 单层吸附和检测气体的潜在缺陷:一种计算方法。
Int J Mol Sci. 2023 Jun 17;24(12):10284. doi: 10.3390/ijms241210284.
9
Gas adsorption effects of monolayer GeSe in terms of anisotropic transport properties.单层GeSe在各向异性输运性质方面的气体吸附效应。
Nanotechnology. 2022 Jul 26;33(42). doi: 10.1088/1361-6528/ac800f.
10
The Adsorption and Sensing Performances of Ir-modified MoS Monolayer toward SF Decomposition Products: A DFT Study.铱修饰的二硫化钼单层对六氟化硫分解产物的吸附和传感性能:一项密度泛函理论研究
Nanomaterials (Basel). 2021 Jan 4;11(1):100. doi: 10.3390/nano11010100.

引用本文的文献

1
Heteroatoms (Si, B, N, and P) doped 2D monolayer MoS for NH gas detection.用于NH₃气体检测的杂原子(硅、硼、氮和磷)掺杂二维单层二硫化钼
RSC Adv. 2022 Sep 13;12(40):25992-26010. doi: 10.1039/d2ra04028j. eCollection 2022 Sep 12.

本文引用的文献

1
Rh-doped MoSe as a toxic gas scavenger: a first-principles study.作为有毒气体清除剂的Rh掺杂MoSe:第一性原理研究。
Nanoscale Adv. 2018 Nov 9;1(2):772-780. doi: 10.1039/c8na00233a. eCollection 2019 Feb 12.
2
Tellurene Nanoflake-Based NO Sensors with Superior Sensitivity and a Sub-Parts-per-Billion Detection Limit.基于碲烯纳米片的具有卓越灵敏度和十亿分之一以下检测限的一氧化氮传感器。
ACS Appl Mater Interfaces. 2020 Oct 21;12(42):47704-47713. doi: 10.1021/acsami.0c15964. Epub 2020 Oct 5.
3
First-Principles Insight into Pd-Doped ZnO Monolayers as a Promising Scavenger for Dissolved Gas Analysis in Transformer Oil.
基于第一性原理对钯掺杂氧化锌单层作为变压器油中溶解气体分析的有前景清除剂的洞察。
ACS Omega. 2020 Jul 7;5(28):17801-17807. doi: 10.1021/acsomega.0c02592. eCollection 2020 Jul 21.
4
An investigation of the positive effects of doping an Al atom on the adsorption of CO on BN nanosheets: a DFT study.铝原子掺杂对BN纳米片上CO吸附的积极影响的研究:一项密度泛函理论研究
Phys Chem Chem Phys. 2020 May 6;22(17):9368-9374. doi: 10.1039/d0cp00714e.
5
Scaling of greenhouse crop production in low sunlight scenarios.在低光照场景下温室作物生产的规模化。
Sci Total Environ. 2020 Mar 10;707:136012. doi: 10.1016/j.scitotenv.2019.136012. Epub 2019 Dec 10.
6
Strain-engineering the in-plane electrical anisotropy of GeSe monolayers.应变工程 GeSe 单层的面内电各向异性。
Phys Chem Chem Phys. 2020 Jan 2;22(2):914-918. doi: 10.1039/c9cp05058b.
7
Pristine and Cu decorated hexagonal InN monolayer, a promising candidate to detect and scavenge SF decompositions based on first-principle study.基于第一性原理研究,原始的和铜修饰的六角氮化铟单层是检测和清除六氟化硫分解产物的一个有前景的候选材料。
J Hazard Mater. 2019 Feb 5;363:346-357. doi: 10.1016/j.jhazmat.2018.10.006. Epub 2018 Oct 6.
8
Experimental Sensing and Density Functional Theory Study of HS and SOF Adsorption on Au-Modified Graphene.HS和SOF在金修饰石墨烯上吸附的实验传感与密度泛函理论研究
Adv Sci (Weinh). 2015 Sep 10;2(11):1500101. doi: 10.1002/advs.201500101. eCollection 2015 Nov.
9
CO, CO2 and H2 adsorption on ZnO, CeO2, and ZnO/CeO2 surfaces: DFT simulations.CO、CO₂和H₂在ZnO、CeO₂以及ZnO/CeO₂表面的吸附:密度泛函理论模拟
J Mol Model. 2014 Jun;20(6):2270. doi: 10.1007/s00894-014-2270-0. Epub 2014 Jun 7.
10
A DFT-D study of structural and energetic properties of TiO2 modifications.基于密度泛函理论的 TiO2 修饰的结构和能量性质研究。
J Phys Condens Matter. 2012 Oct 24;24(42):424206. doi: 10.1088/0953-8984/24/42/424206. Epub 2012 Oct 3.