CAS OpenIR
Occurrence mode and molecular structure model of unburned carbon in coal gasification fine slags
Shi, Da1,2; Zhang, Jianbo2; Hou, Xinjuan2,3; Li, Shaopeng2; Li, Huiquan2,3; He, Fayu4; Zhu, Ganyu2
2022-09-01
Source PublicationFUEL
ISSN0016-2361
Volume323Pages:7
AbstractCoal gasification fine slag (CGFS) is a kind of solid waste produced in the process of coal gasification, in which unburned carbon (UC) severely restricts its resource utilization. The study of physical/chemical properties, occurrence state and molecular structure of UC is of great significance to the utilization of CGFS. The characterization results show that the carbon content of particles increases with the increase of particle size, which is enriched to concentrate in particle size above 125 mu m. UC is loose and porous, which leads to the wrapping and covering with inorganic ash particles. The molecular formula of the UC is determined to be C178H73O46N1S1, with a molecular weight of 2991. The average macromolecular structure model of UC is established by computer simulation. It is basically consistent with the infrared results of the simulation experiment. From the perspective of structure, UC has a high degree of aromatization and abundant oxygen-containing functional groups, which may increase the difficulty of decarbonization by enhancing hydrophilicity. This work provides a comprehensive understanding of UC structure at the atomic level, which is conducive to the efficient decarbonization of CGFS.
KeywordGasification slag Structure model Unburned carbon Molecular simulation
DOI10.1016/j.fuel.2022.124364
Language英语
WOS KeywordRESIDUAL CARBON ; CHAR STRUCTURE ; ASH ; SURFACE ; PARTICLES ; CONSTRUCTION ; COMBUSTION ; REACTIVITY ; VITRINITE ; ELEMENTS
Funding ProjectNational Nature Science Foundation of China[52174390] ; National Nature Science Foundation of China[U1810205] ; Strategic Priority Research Program of the Chinese Academy of Sciences China[XDA21040601]
WOS Research AreaEnergy & Fuels ; Engineering
WOS SubjectEnergy & Fuels ; Engineering, Chemical
Funding OrganizationNational Nature Science Foundation of China ; Strategic Priority Research Program of the Chinese Academy of Sciences China
WOS IDWOS:000803863200008
PublisherELSEVIER SCI LTD
Citation statistics
Document Type期刊论文
Identifierhttp://ir.ipe.ac.cn/handle/122111/53500
Collection中国科学院过程工程研究所
Corresponding AuthorZhang, Jianbo; He, Fayu
Affiliation1.Northeastern Univ, Sch Resources & Civil Engn, Shenyang 110819, Peoples R China
2.Chinese Acad Sci, Inst Proc Engn, Natl Engn Res Ctr Green Recycling Strateg Met Reso, CAS Key Lab Green Proc & Engn, Beijing 100090, Peoples R China
3.Univ Chinese Acad Sci, Sch Chem Engn, Beijing 100049, Peoples R China
4.China Minmetals Corp, Beijing 100010, Peoples R China
Recommended Citation
GB/T 7714
Shi, Da,Zhang, Jianbo,Hou, Xinjuan,et al. Occurrence mode and molecular structure model of unburned carbon in coal gasification fine slags[J]. FUEL,2022,323:7.
APA Shi, Da.,Zhang, Jianbo.,Hou, Xinjuan.,Li, Shaopeng.,Li, Huiquan.,...&Zhu, Ganyu.(2022).Occurrence mode and molecular structure model of unburned carbon in coal gasification fine slags.FUEL,323,7.
MLA Shi, Da,et al."Occurrence mode and molecular structure model of unburned carbon in coal gasification fine slags".FUEL 323(2022):7.
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