Xun Zhang , Chen Yu , Bing Lu , Gang Bai , Huimin Liang , Jieyu Li
{"title":"Experimental study and mechanism analysis of coal spontaneous combustion inhibition based on oxidation characteristics of key coal reaction groups","authors":"Xun Zhang , Chen Yu , Bing Lu , Gang Bai , Huimin Liang , Jieyu Li","doi":"10.1016/j.ces.2025.121656","DOIUrl":null,"url":null,"abstract":"<div><div>Based on the staged oxidation development process dominated by the temperature node of coal itself, the correlation contribution of the staged oxidation reaction of key active groups is thoroughly analyzed. The mathematical relationship between macroscopic gas characteristics and microscopic active groups of different coal samples was established. The exothermic mechanism of the self-reaction associated with the key active groups during the staged oxidation of coal was investigated using quantum chemical calculations. The performance of inhibitors is significantly diminished during the latent development stage of coal. The key temperature node accelerates the desorption of crystal water from the physical inhibitor, enabling it to act more effectively on the coal body. Meanwhile, the chemical antioxidant becomes more active in quenching and capturing key active groups, thereby inhibiting the chain reaction process and the release of heat from self-reactions. The critical temperature inhibition method ensures a more comprehensive suppression of coal oxidation at key stages. The research provides valuable insights and data support for enhancing the safety of coal storage and transportation.</div></div>","PeriodicalId":271,"journal":{"name":"Chemical Engineering Science","volume":"312 ","pages":"Article 121656"},"PeriodicalIF":4.1000,"publicationDate":"2025-04-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Chemical Engineering Science","FirstCategoryId":"5","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0009250925004798","RegionNum":2,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"ENGINEERING, CHEMICAL","Score":null,"Total":0}
引用次数: 0
Abstract
Based on the staged oxidation development process dominated by the temperature node of coal itself, the correlation contribution of the staged oxidation reaction of key active groups is thoroughly analyzed. The mathematical relationship between macroscopic gas characteristics and microscopic active groups of different coal samples was established. The exothermic mechanism of the self-reaction associated with the key active groups during the staged oxidation of coal was investigated using quantum chemical calculations. The performance of inhibitors is significantly diminished during the latent development stage of coal. The key temperature node accelerates the desorption of crystal water from the physical inhibitor, enabling it to act more effectively on the coal body. Meanwhile, the chemical antioxidant becomes more active in quenching and capturing key active groups, thereby inhibiting the chain reaction process and the release of heat from self-reactions. The critical temperature inhibition method ensures a more comprehensive suppression of coal oxidation at key stages. The research provides valuable insights and data support for enhancing the safety of coal storage and transportation.
期刊介绍:
Chemical engineering enables the transformation of natural resources and energy into useful products for society. It draws on and applies natural sciences, mathematics and economics, and has developed fundamental engineering science that underpins the discipline.
Chemical Engineering Science (CES) has been publishing papers on the fundamentals of chemical engineering since 1951. CES is the platform where the most significant advances in the discipline have ever since been published. Chemical Engineering Science has accompanied and sustained chemical engineering through its development into the vibrant and broad scientific discipline it is today.