Knowledge Management System Of Guangzhou Institute of Energy Conversion, CAS
| Molecular Dynamics Simulation on Characteristics of Decomposition of Methane Hydrate in the Presence of Hydrogen Peroxide Solution | |
| Alternative Title | 过氧化氢水溶液作用下甲烷水合物分解特性的分子动力学模拟研究 |
Wan Lihua1,2 ; Yan Kefeng1,3; Li Xiaosen1,3; Huang Ningsheng1; Tang Liangguang1
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| 2009-09-28 | |
| Source Publication | ACTA CHIMICA SINICA
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| ISSN | 0567-7351 |
| Volume | 67Issue:18Pages:2149-2154 |
| Corresponding Author | lixs@giec.ac.cn |
| Abstract | In this work, the characteristics of the decomposition of methane hydrate Structure I (SI) in the presence of hydrogen peroxide solution is investigated using the molecular dynamics simulation. The mechanism of the transformation process from the solid hydrate to the liquid is analyzed with the effect of hydrogen peroxide (HP) solution. In addition, the effect of ethylene glycol (EG) with the same molar concentration with HP on the methane hydrate dissociation is also studied. The results illustrate that both HP and EG promote well the hydrate dissociation. The work provides the important reference value for the experimental investigation into the promotion effect of HP on the hydrate dissociation. |
| Subtype | Article |
| Other Abstract | In this work, the characteristics of the decomposition of methane hydrate Structure I (SI) in the presence of hydrogen peroxide solution is investigated using the molecular dynamics simulation. The mechanism of the transformation process from the solid hydrate to the liquid is analyzed with the effect of hydrogen peroxide (HP) solution. In addition, the effect of ethylene glycol (EG) with the same molar concentration with HP on the methane hydrate dissociation is also studied. The results illustrate that both HP and EG promote well the hydrate dissociation. The work provides the important reference value for the experimental investigation into the promotion effect of HP on the hydrate dissociation. |
| Keyword | Gas Hydrate Dissociation Hydrogen Peroxide Solution Molecular Dynamics Simulation |
| WOS Headings | Science & Technology ; Physical Sciences |
| WOS Subject Extended | Chemistry |
| URL | 查看原文 |
| WOS Keyword | ETHYLENE-GLYCOL ; CRYSTAL-STRUCTURE ; GAS-PRODUCTION ; 2-AMINOETHANOL ; DISSOCIATION |
| Indexed By | SCI |
| Language | 英语 |
| Funding Organization | 国家自然科学基金(Nos20676133,20773133);国家高技术研究发展计划(No2006AA05Z319);中科院重大科研装备(NoYZ200717);中过科学院知识创新工程重要方向(NoKGCX2-YW-3X6);国家-广东省自然科学联合基金项目(NoU0733003);973计划(No2009CB219507) |
| WOS Subject | Chemistry, Multidisciplinary |
| WOS ID | WOS:000270999600016 |
| Citation statistics | |
| Document Type | 期刊论文 |
| Identifier | http://ir.giec.ac.cn/handle/344007/3298 |
| Collection | 中国科学院广州能源研究所 |
| Affiliation | 1.Chinese Acad Sci, Guangzhou Inst Energy Convers, Ctr Gas Hydrate Res, Guangzhou 510640, Guangdong, Peoples R China 2.Chinese Acad Sci, China Grad Sch, Beijing 100039, Peoples R China 3.Chinese Acad Sci, Key Lab Renewable Energy & Gas Hydrate, Guangzhou 510640, Guangdong, Peoples R China |
| First Author Affilication | GuangZhou Institute of Energy Conversion,Chinese Academy of Sciences |
| Recommended Citation GB/T 7714 | Wan Lihua,Yan Kefeng,Li Xiaosen,et al. Molecular Dynamics Simulation on Characteristics of Decomposition of Methane Hydrate in the Presence of Hydrogen Peroxide Solution[J]. ACTA CHIMICA SINICA,2009,67(18):2149-2154. |
| APA | Wan Lihua,Yan Kefeng,Li Xiaosen,Huang Ningsheng,&Tang Liangguang.(2009).Molecular Dynamics Simulation on Characteristics of Decomposition of Methane Hydrate in the Presence of Hydrogen Peroxide Solution.ACTA CHIMICA SINICA,67(18),2149-2154. |
| MLA | Wan Lihua,et al."Molecular Dynamics Simulation on Characteristics of Decomposition of Methane Hydrate in the Presence of Hydrogen Peroxide Solution".ACTA CHIMICA SINICA 67.18(2009):2149-2154. |
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