烟尘颗粒表面形态对其生长动力学的影响：分子动力学研究

IF 1 4区物理与天体物理 Q4 PHYSICS, APPLIED

High Temperature Pub Date : 2024-02-29 DOI:10.1134/s0018151x23010170

K. D. Goldstein, M. A. Logunov, D. O. Potapov, N. D. Orekhov

{"title":"烟尘颗粒表面形态对其生长动力学的影响：分子动力学研究","authors":"K. D. Goldstein, M. A. Logunov, D. O. Potapov, N. D. Orekhov","doi":"10.1134/s0018151x23010170","DOIUrl":null,"url":null,"abstract":"<h3 data-test=\"abstract-sub-heading\">Abstract</h3><p>As a soot particle grows, it undergoes a number of significant morphological changes (called aging), which lead to a decrease in reactivity of the particle surface. This work uses reactive molecular dynamics to study the interaction between acetylene molecules in the gas phase and the surface of soot particles of varying degrees of maturity. It is demonstrated that the branched morphology of “young” soot particles and the presence of nanosized voids on their surface can be another effect that has a significant impact on the higher reactivity of soot particles.</p>","PeriodicalId":13163,"journal":{"name":"High Temperature","volume":null,"pages":null},"PeriodicalIF":1.0000,"publicationDate":"2024-02-29","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Influence of the Surface Morphology of Soot Particles on Their Growth Kinetics: A Molecular Dynamics Study\",\"authors\":\"K. D. Goldstein, M. A. Logunov, D. O. Potapov, N. D. Orekhov\",\"doi\":\"10.1134/s0018151x23010170\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<h3 data-test=\\\"abstract-sub-heading\\\">Abstract</h3><p>As a soot particle grows, it undergoes a number of significant morphological changes (called aging), which lead to a decrease in reactivity of the particle surface. This work uses reactive molecular dynamics to study the interaction between acetylene molecules in the gas phase and the surface of soot particles of varying degrees of maturity. It is demonstrated that the branched morphology of “young” soot particles and the presence of nanosized voids on their surface can be another effect that has a significant impact on the higher reactivity of soot particles.</p>\",\"PeriodicalId\":13163,\"journal\":{\"name\":\"High Temperature\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":1.0000,\"publicationDate\":\"2024-02-29\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"High Temperature\",\"FirstCategoryId\":\"101\",\"ListUrlMain\":\"https://doi.org/10.1134/s0018151x23010170\",\"RegionNum\":4,\"RegionCategory\":\"物理与天体物理\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q4\",\"JCRName\":\"PHYSICS, APPLIED\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"High Temperature","FirstCategoryId":"101","ListUrlMain":"https://doi.org/10.1134/s0018151x23010170","RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"PHYSICS, APPLIED","Score":null,"Total":0}

引用次数: 0

摘要

摘要随着烟尘颗粒的长大，它会发生一系列显著的形态变化（称为老化），从而导致颗粒表面的反应性降低。这项研究利用反应分子动力学来研究气相中乙炔分子与不同成熟度的烟尘颗粒表面之间的相互作用。结果表明，"年轻 "烟尘颗粒的分枝形态及其表面纳米级空隙的存在可能是对烟尘颗粒较高反应性产生重大影响的另一种效应。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

Influence of the Surface Morphology of Soot Particles on Their Growth Kinetics: A Molecular Dynamics Study

查看原文本刊更多论文

Influence of the Surface Morphology of Soot Particles on Their Growth Kinetics: A Molecular Dynamics Study

Abstract

As a soot particle grows, it undergoes a number of significant morphological changes (called aging), which lead to a decrease in reactivity of the particle surface. This work uses reactive molecular dynamics to study the interaction between acetylene molecules in the gas phase and the surface of soot particles of varying degrees of maturity. It is demonstrated that the branched morphology of “young” soot particles and the presence of nanosized voids on their surface can be another effect that has a significant impact on the higher reactivity of soot particles.

求助全文

通过发布文献求助，成功后即可免费获取论文全文。去求助

来源期刊

High Temperature 物理-物理：应用

CiteScore

1.50

自引率

40.00%

发文量

审稿时长

4-8 weeks

期刊介绍： High Temperature is an international peer reviewed journal that publishes original papers and reviews written by theoretical and experimental researchers. The journal deals with properties and processes in low-temperature plasma; thermophysical properties of substances including pure materials, mixtures and alloys; the properties in the vicinity of the critical point, equations of state; phase equilibrium; heat and mass transfer phenomena, in particular, by forced and free convections; processes of boiling and condensation, radiation, and complex heat transfer; experimental methods and apparatuses; high-temperature facilities for power engineering applications, etc. The journal reflects the current trends in thermophysical research. It presents the results of present-day experimental and theoretical studies in the processes of complex heat transfer, thermal, gas dynamic processes, and processes of heat and mass transfer, as well as the latest advances in the theoretical description of the properties of high-temperature media.